SpectraBase Compound ID | 1ZtURgZYXV |
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InChI | InChI=1S/C21H22ClN3S/c1-5-14-26-20-24-23-19(25(20)18-12-10-17(22)11-13-18)15-6-8-16(9-7-15)21(2,3)4/h5-13H,1,14H2,2-4H3 |
InChIKey | BJSJWVISSPDZRM-UHFFFAOYSA-N |
Mol Weight | 383.94 g/mol |
Molecular Formula | C21H22ClN3S |
Exact Mass | 383.122297 g/mol |
SpectraBase Spectrum ID | 7tTeJSb84e8 |
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Name | 5-(allylthio)-(p-tert-butylphenyl)-4-(p-chlorophenyl)-4H-1,2,4-triazole |
Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C21H22ClN3S |
InChI | InChI=1S/C21H22ClN3S/c1-5-14-26-20-24-23-19(25(20)18-12-10-17(22)11-13-18)15-6-8-16(9-7-15)21(2,3)4/h5-13H,1,14H2,2-4H3 |
InChIKey | BJSJWVISSPDZRM-UHFFFAOYSA-N |
Instrument Name | Varian CFT-20 |
Sadtler NMR Number | 46945M |
Solvent | CDCl3 |