![4-methyl-3-(2-methyl-4-thiazolyl)-5-[(2-nitro-alpha,alpha,alpha-trifluoro-p-tolyl)thio]-4H-1,2,4-triazole](/api/spectrum/7AhcjNKkzWO/structure.png?h=300&w=458 "4-methyl-3-(2-methyl-4-thiazolyl)-5-[(2-nitro-alpha,alpha,alpha-trifluoro-p-tolyl)thio]-4H-1,2,4-triazole")
| SpectraBase Compound ID | 7f952aRA0jr |
|---|---|
| InChI | InChI=1S/C14H10F3N5O2S2/c1-7-18-9(6-25-7)12-19-20-13(21(12)2)26-11-4-3-8(14(15,16)17)5-10(11)22(23)24/h3-6H,1-2H3 |
| InChIKey | YWXBLWVXJCYSRO-UHFFFAOYSA-N |
| Mol Weight | 401.38 g/mol |
| Molecular Formula | C14H10F3N5O2S2 |
| Exact Mass | 401.022801 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7AhcjNKkzWO |
|---|---|
| Name | 4-methyl-3-(2-methyl-4-thiazolyl)-5-[(2-nitro-alpha,alpha,alpha-trifluoro-p-tolyl)thio]-4H-1,2,4-triazole |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C14H10F3N5O2S2 |
| InChI | InChI=1S/C14H10F3N5O2S2/c1-7-18-9(6-25-7)12-19-20-13(21(12)2)26-11-4-3-8(14(15,16)17)5-10(11)22(23)24/h3-6H,1-2H3 |
| InChIKey | YWXBLWVXJCYSRO-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 58185M |
| Solvent | CDCl3 |