| SpectraBase Compound ID | 6WCT2H2EZKe |
|---|---|
| InChI | InChI=1S/C22H19NO2S/c1-18-8-12-20(13-9-18)16-17-23(21-6-4-3-5-7-21)26(24,25)22-14-10-19(2)11-15-22/h3-15H,1-2H3 |
| InChIKey | KCHOVBARUYLZLB-UHFFFAOYSA-N |
| Mol Weight | 361.46 g/mol |
| Molecular Formula | C22H19NO2S |
| Exact Mass | 361.11365 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2fUaIdE7eG6 |
|---|---|
| Name | N-(4-Methylphenyl)ethynyl-N-phenyl tosylamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 361.113650028 u |
| Formula | C22H19NO2S |
| InChI | InChI=1S/C22H19NO2S/c1-18-8-12-20(13-9-18)16-17-23(21-6-4-3-5-7-21)26(24,25)22-14-10-19(2)11-15-22/h3-15H,1-2H3 |
| InChIKey | KCHOVBARUYLZLB-UHFFFAOYSA-N |
| Molecular Weight | 361.459 g/mol |
| SMILES | C(N(S(C1=CC=C(C=C1)C)(=O)=O)C=1C=CC=CC1)#CC=1C=CC(=CC1)C |