![Acetamide, 2,2,2-trifluoro-N-[3-(3,5-dimethylpyrazol-1-yl)-5-mercapto-1,2,4-triazol-4-yl]-](/api/spectrum/26eMoEKztkS/structure.png?h=300&w=458 "Acetamide, 2,2,2-trifluoro-N-[3-(3,5-dimethylpyrazol-1-yl)-5-mercapto-1,2,4-triazol-4-yl]-")
| SpectraBase Compound ID | ChF3gnpPGDy |
|---|---|
| InChI | InChI=1S/C9H9F3N6OS/c1-4-3-5(2)17(15-4)7-13-14-8(20)18(7)16-6(19)9(10,11)12/h3H,1-2H3,(H,14,20)(H,16,19) |
| InChIKey | LSJUHZJHPOJGEE-UHFFFAOYSA-N |
| Mol Weight | 306.27 g/mol |
| Molecular Formula | C9H9F3N6OS |
| Exact Mass | 306.051065 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 26eMoEKztkS |
|---|---|
| Name | Acetamide, 2,2,2-trifluoro-N-[3-(3,5-dimethylpyrazol-1-yl)-5-mercapto-1,2,4-triazol-4-yl]- |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H9F3N6OS |
| InChI | InChI=1S/C9H9F3N6OS/c1-4-3-5(2)17(15-4)7-13-14-8(20)18(7)16-6(19)9(10,11)12/h3H,1-2H3,(H,14,20)(H,16,19) |
| InChIKey | LSJUHZJHPOJGEE-UHFFFAOYSA-N |
| Molecular Weight | 306.267 g/mol |
| SMILES | Sc1nnc([n]1NC(C(F)(F)F)=O)-[n]1nc(C)cc1C |
| SPLASH | splash10-0002-9301000000-d330309f28b7c5157f1c |
| Source of Spectrum | AD-0-2532-0 |
| Synonyms | N-[3-(3,5-dimethyl-1-pyrazolyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-2,2,2-trifluoroacetamide N-[3-(3,5-Dimethyl-1H-pyrazol-1-yl)-5-sulfanyl-4H-1,2,4-triazol-4-yl]-2,2,2-trifluoroacetamide N-[3-(3,5-dimethylpyrazol-1-yl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-2,2,2-trifluoroacetamide N-[3-(3,5-dimethylpyrazol-1-yl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-2,2,2-tris(fluoranyl)ethanamide N-[3-(3,5-dimethylpyrazol-1-yl)-5-thioxo-1H-1,2,4-triazol-4-yl]-2,2,2-trifluoro-acetamide |
| Wiley ID | 1426571 |