![3-(p-tert-butylphenyl)-4-methyl-5-[(2-propynyl)thio]-4H-1,2,4-triazole](/api/spectrum/F6bj54UKhAm/structure.png?h=300&w=458 "3-(p-tert-butylphenyl)-4-methyl-5-[(2-propynyl)thio]-4H-1,2,4-triazole")
| SpectraBase Compound ID | J2kjoGTAflH |
|---|---|
| InChI | InChI=1S/C16H19N3S/c1-6-11-20-15-18-17-14(19(15)5)12-7-9-13(10-8-12)16(2,3)4/h1,7-10H,11H2,2-5H3 |
| InChIKey | LUKAUOGWSZEEGC-UHFFFAOYSA-N |
| Mol Weight | 285.41 g/mol |
| Molecular Formula | C16H19N3S |
| Exact Mass | 285.129969 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | F6bj54UKhAm |
|---|---|
| Name | 3-(p-tert-butylphenyl)-4-methyl-5-[(2-propynyl)thio]-4H-1,2,4-triazole |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C16H19N3S |
| InChI | InChI=1S/C16H19N3S/c1-6-11-20-15-18-17-14(19(15)5)12-7-9-13(10-8-12)16(2,3)4/h1,7-10H,11H2,2-5H3 |
| InChIKey | LUKAUOGWSZEEGC-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 48110M |
| Solvent | CDCl3 |