![5-(o-chlorophenyl)-3-{alpha-{[4-methyl-5-(trifluoromethyl)-4H-1,2,4-triazol-3-yl]thio}-m-tolyl}-1,2,4-oxadiazole](/api/spectrum/FJ4h2Vr0DNf/structure.png?h=300&w=458 "5-(o-chlorophenyl)-3-{alpha-{[4-methyl-5-(trifluoromethyl)-4H-1,2,4-triazol-3-yl]thio}-m-tolyl}-1,2,4-oxadiazole")
| SpectraBase Compound ID | E1UwDIa1KhD |
|---|---|
| InChI | InChI=1S/C19H13ClF3N5OS/c1-28-17(19(21,22)23)25-26-18(28)30-10-11-5-4-6-12(9-11)15-24-16(29-27-15)13-7-2-3-8-14(13)20/h2-9H,10H2,1H3 |
| InChIKey | XOEDRTJYGIGKNB-UHFFFAOYSA-N |
| Mol Weight | 451.86 g/mol |
| Molecular Formula | C19H13ClF3N5OS |
| Exact Mass | 451.048143 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FJ4h2Vr0DNf |
|---|---|
| Name | 5-(o-chlorophenyl)-3-{alpha-{[4-methyl-5-(trifluoromethyl)-4H-1,2,4-triazol-3-yl]thio}-m-tolyl}-1,2,4-oxadiazole |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C19H13ClF3N5OS |
| InChI | InChI=1S/C19H13ClF3N5OS/c1-28-17(19(21,22)23)25-26-18(28)30-10-11-5-4-6-12(9-11)15-24-16(29-27-15)13-7-2-3-8-14(13)20/h2-9H,10H2,1H3 |
| InChIKey | XOEDRTJYGIGKNB-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 59040M |
| Solvent | CDCl3 |