![6-[(4,6-Dimethyl-2-pyrimidinyl)sulfanyl]-3-(1,1,2,2,3,3,3-heptafluoropropyl)[1,2,4]triazolo[4,3-b]pyridazine](/api/spectrum/JsHaAjYw0YN/structure.png?h=300&w=458 "6-[(4,6-Dimethyl-2-pyrimidinyl)sulfanyl]-3-(1,1,2,2,3,3,3-heptafluoropropyl)[1,2,4]triazolo[4,3-b]pyridazine")
| SpectraBase Compound ID | HH3Kr9MEOM5 |
|---|---|
| InChI | InChI=1S/C14H9F7N6S/c1-6-5-7(2)23-11(22-6)28-9-4-3-8-24-25-10(27(8)26-9)12(15,16)13(17,18)14(19,20)21/h3-5H,1-2H3 |
| InChIKey | FVSATDQRASQLEK-UHFFFAOYSA-N |
| Mol Weight | 426.32 g/mol |
| Molecular Formula | C14H9F7N6S |
| Exact Mass | 426.049763 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | JsHaAjYw0YN |
|---|---|
| Name | 6-[(4,6-Dimethyl-2-pyrimidinyl)sulfanyl]-3-(1,1,2,2,3,3,3-heptafluoropropyl)[1,2,4]triazolo[4,3-b]pyridazine |
| CAS Registry Number | 351346-36-6 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C14H9F7N6S |
| InChI | InChI=1S/C14H9F7N6S/c1-6-5-7(2)23-11(22-6)28-9-4-3-8-24-25-10(27(8)26-9)12(15,16)13(17,18)14(19,20)21/h3-5H,1-2H3 |
| InChIKey | FVSATDQRASQLEK-UHFFFAOYSA-N |
| Molecular Weight | 426.317 g/mol |
| SMILES | c1(C(C(C(F)(F)F)(F)F)(F)F)[n]2c(C=CC(=N2)Sc2nc(C)cc(n2)C)nn1 |
| SPLASH | splash10-00or-9630300000-fd775f35f41b861b3eb7 |
| Synonyms | 1,2,4-Triazolo[4,3-b]pyridazine, 3-heptafluoropropyl-6-(4,6-dimethyl-2-pyrimidylthio)- 6-(4,6-dimethylpyrimidin-2-yl)sulfanyl-3-(1,1,2,2,3,3,3-heptafluoropropyl)-[1,2,4]triazolo[4,3-b]pyridazine 6-(4,6-dimethylpyrimidin-2-yl)sulfanyl-3-[1,1,2,2,3,3,3-heptakis(fluoranyl)propyl]-[1,2,4]triazolo[4,3-b]pyridazine 6-[(4,6-dimethyl-2-pyrimidinyl)thio]-3-(1,1,2,2,3,3,3-heptafluoropropyl)-[1,2,4]triazolo[4,3-b]pyridazine 6-[(4,6-dimethylpyrimidin-2-yl)thio]-3-(1,1,2,2,3,3,3-heptafluoropropyl)-[1,2,4]triazolo[4,3-b]pyridazine |
| Wiley ID | 1455470 |