| SpectraBase Compound ID | 15eccq04svu |
|---|---|
| InChI | InChI=1S/C15H21NS2/c1-4-5-11-15(17)14(2,3)16-13(18-15)12-9-7-6-8-10-12/h6-10,17H,4-5,11H2,1-3H3 |
| InChIKey | SRRGZQBENQXBHO-UHFFFAOYSA-N |
| Mol Weight | 279.46 g/mol |
| Molecular Formula | C15H21NS2 |
| Exact Mass | 279.111542 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HJ6mTKXhvYD |
|---|---|
| Name | 5-Butyl-4,4-dimethyl-2-phenyl-1,3-thiazole-5-thiol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 279.111542028 u |
| Formula | C15H21NS2 |
| InChI | InChI=1S/C15H21NS2/c1-4-5-11-15(17)14(2,3)16-13(18-15)12-9-7-6-8-10-12/h6-10,17H,4-5,11H2,1-3H3 |
| InChIKey | SRRGZQBENQXBHO-UHFFFAOYSA-N |
| SMILES | C=1(SC(C(N1)(C)C)(S)CCCC)C1=CC=CC=C1 |