| SpectraBase Compound ID | 6GHbkFOAuNa |
|---|---|
| InChI | InChI=1S/C17H25N3O2S/c1-11(2)14-7-15(12(3)4)17(16(8-14)13(5)6)23(21,22)20-10-18-9-19-20/h7-13H,1-6H3 |
| InChIKey | BKJMMUUBRUWPPQ-UHFFFAOYSA-N |
| Mol Weight | 335.47 g/mol |
| Molecular Formula | C17H25N3O2S |
| Exact Mass | 335.166748 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CAJh4On4F1x |
|---|---|
| Name | 1-(2,4,6-Triisopropylphenylsulfonyl)-1,2,4-triazole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 335.166748229 u |
| Formula | C17H25N3O2S |
| InChI | InChI=1S/C17H25N3O2S/c1-11(2)14-7-15(12(3)4)17(16(8-14)13(5)6)23(21,22)20-10-18-9-19-20/h7-13H,1-6H3 |
| InChIKey | BKJMMUUBRUWPPQ-UHFFFAOYSA-N |
| Molecular Weight | 335.466 g/mol |
| SMILES | C1=C(C(=C(C=C1C(C)C)C(C)C)S(=O)(=O)N1N=CN=C1)C(C)C |