![acetamide, 2-[(4-methyl-4H-1,2,4-triazol-3-yl)thio]-N-[3-(trifluoromethyl)phenyl]-](/api/spectrum/rQXXGPoCqB/structure.png?h=300&w=458 "acetamide, 2-[(4-methyl-4H-1,2,4-triazol-3-yl)thio]-N-[3-(trifluoromethyl)phenyl]-")
| SpectraBase Compound ID | NjSopA4rE5 |
|---|---|
| InChI | InChI=1S/C12H11F3N4OS/c1-19-7-16-18-11(19)21-6-10(20)17-9-4-2-3-8(5-9)12(13,14)15/h2-5,7H,6H2,1H3,(H,17,20) |
| InChIKey | SHHJVZLCZARUGZ-UHFFFAOYSA-N |
| Mol Weight | 316.3 g/mol |
| Molecular Formula | C12H11F3N4OS |
| Exact Mass | 316.060567 g/mol |
1H Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | rQXXGPoCqB |
|---|---|
| Name | N-(3-trifluoromethylphenyl) 4-methyl-4H-1,2,4-triazol-3-ylthioacetate |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C12H11F3N4OS |
| InChI | InChI=1S/C12H11F3N4OS/c1-19-7-16-18-11(19)21-6-10(20)17-9-4-2-3-8(5-9)12(13,14)15/h2-5,7H,6H2,1H3,(H,17,20) |
| InChIKey | SHHJVZLCZARUGZ-UHFFFAOYSA-N |
| Instrument Name | Bruker AM-300 |
| NMR Standard | DMSO-d5 1H |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | DMSO-d6 |