![3-(5-chlorobenzo[b]thien-3-yl)-4-methyl-5-{[p-(trifluoromethyl)benzyl]thio}-4H-1,2,4-triazole](/api/spectrum/5cFSZ04egRG/structure.png?h=300&w=458 "3-(5-chlorobenzo[b]thien-3-yl)-4-methyl-5-{[p-(trifluoromethyl)benzyl]thio}-4H-1,2,4-triazole")
| SpectraBase Compound ID | 2DRj5t0mJUY |
|---|---|
| InChI | InChI=1S/C19H13ClF3N3S2/c1-26-17(15-10-27-16-7-6-13(20)8-14(15)16)24-25-18(26)28-9-11-2-4-12(5-3-11)19(21,22)23/h2-8,10H,9H2,1H3 |
| InChIKey | WTMFWRYBZJXFSR-UHFFFAOYSA-N |
| Mol Weight | 439.9 g/mol |
| Molecular Formula | C19H13ClF3N3S2 |
| Exact Mass | 439.019152 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5cFSZ04egRG |
|---|---|
| Name | 3-(5-chlorobenzo[b]thien-3-yl)-4-methyl-5-{[p-(trifluoromethyl)benzyl]thio}-4H-1,2,4-triazole |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C19H13ClF3N3S2 |
| InChI | InChI=1S/C19H13ClF3N3S2/c1-26-17(15-10-27-16-7-6-13(20)8-14(15)16)24-25-18(26)28-9-11-2-4-12(5-3-11)19(21,22)23/h2-8,10H,9H2,1H3 |
| InChIKey | WTMFWRYBZJXFSR-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 57376M |
| Solvent | CDCl3 |