| SpectraBase Compound ID | KgvLmUIzFzu |
|---|---|
| InChI | InChI=1S/C15H21NO2S/c1-6-7-14(15(3,4)5)16-19(17,18)13-10-8-12(2)9-11-13/h1,8-11,14,16H,7H2,2-5H3 |
| InChIKey | ZBWBMKOXMYAGMD-UHFFFAOYSA-N |
| Mol Weight | 279.4 g/mol |
| Molecular Formula | C15H21NO2S |
| Exact Mass | 279.1293 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | LQQt57hNiHU |
|---|---|
| Name | 5,5-Dimethyl-4-N-(p-toluenesulfonyl)amino-1-hexyne |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 279.129300092 u |
| Formula | C15H21NO2S |
| InChI | InChI=1S/C15H21NO2S/c1-6-7-14(15(3,4)5)16-19(17,18)13-10-8-12(2)9-11-13/h1,8-11,14,16H,7H2,2-5H3 |
| InChIKey | ZBWBMKOXMYAGMD-UHFFFAOYSA-N |
| Molecular Weight | 279.398 g/mol |
| SMILES | C(NS(C=1C=CC(=CC1)C)(=O)=O)(C(C)(C)C)CC#C |