![4-((E)-{[3-sulfanyl-5-(trifluoromethyl)-4H-1,2,4-triazol-4-yl]imino}methyl)phenol](/api/spectrum/3RQ0XRFtR2n/structure.png?h=300&w=458 "4-((E)-{[3-sulfanyl-5-(trifluoromethyl)-4H-1,2,4-triazol-4-yl]imino}methyl)phenol")
| SpectraBase Compound ID | XlqxNEsztn |
|---|---|
| InChI | InChI=1S/C10H7F3N4OS/c11-10(12,13)8-15-16-9(19)17(8)14-5-6-1-3-7(18)4-2-6/h1-5,18H,(H,16,19)/b14-5+ |
| InChIKey | XAJFSXCDNPQGHJ-LHHJGKSTSA-N |
| Mol Weight | 288.25 g/mol |
| Molecular Formula | C10H7F3N4OS |
| Exact Mass | 288.029267 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 3RQ0XRFtR2n |
|---|---|
| Name | 4-[(3-Mercapto-5-trifluoromethyl-[1,2,4]triazol-4-ylimino)-methyl]-phenol |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C10H7F3N4OS |
| InChI | InChI=1S/C10H7F3N4OS/c11-10(12,13)8-15-16-9(19)17(8)14-5-6-1-3-7(18)4-2-6/h1-5,18H,(H,16,19)/b14-5+ |
| InChIKey | XAJFSXCDNPQGHJ-LHHJGKSTSA-N |
| Molecular Weight | 288.248 g/mol |
| SMILES | Sc1nnc([n]1\N=C\c1ccc(cc1)O)C(F)(F)F |
| SPLASH | splash10-014i-8900000000-21c732719a343e726959 |
| Wiley ID | 1463293 |