![5-{[(5-hydroxy-4-phenyl-4H-1,2,4-triazol-3-yl)thio]methyl}-3-isoxazolecarboxylic acid, ethyl ester](/api/spectrum/B6pnZ2v5lPW/structure.png?h=300&w=458 "5-{[(5-hydroxy-4-phenyl-4H-1,2,4-triazol-3-yl)thio]methyl}-3-isoxazolecarboxylic acid, ethyl ester")
| SpectraBase Compound ID | Bl75HBkO4dY |
|---|---|
| InChI | InChI=1S/C15H14N4O4S/c1-2-22-13(20)12-8-11(23-18-12)9-24-15-17-16-14(21)19(15)10-6-4-3-5-7-10/h3-8H,2,9H2,1H3,(H,16,21) |
| InChIKey | ZALVFPLOWCUKBL-UHFFFAOYSA-N |
| Mol Weight | 346.36 g/mol |
| Molecular Formula | C15H14N4O4S |
| Exact Mass | 346.073576 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | B6pnZ2v5lPW |
|---|---|
| Name | 5-{[(5-hydroxy-4-phenyl-4H-1,2,4-triazol-3-yl)thio]methyl}-3-isoxazolecarboxylic acid, ethyl ester |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C15H14N4O4S |
| InChI | InChI=1S/C15H14N4O4S/c1-2-22-13(20)12-8-11(23-18-12)9-24-15-17-16-14(21)19(15)10-6-4-3-5-7-10/h3-8H,2,9H2,1H3,(H,16,21) |
| InChIKey | ZALVFPLOWCUKBL-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 56784M |
| Solvent | Polysol |