| SpectraBase Compound ID | 478RxlnKX2j |
|---|---|
| InChI | InChI=1S/2C7H9NO2S/c1-6-2-4-7(5-3-6)11(8,9)10;1-6-4-2-3-5-7(6)11(8,9)10/h2*2-5H,1H3,(H2,8,9,10) |
| InChIKey | VXGAPBLISGTEKE-UHFFFAOYSA-N |
| Mol Weight | 342.43 g/mol |
| Molecular Formula | C14H18N2O4S2 |
| Exact Mass | 342.070799 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2DffwKqA6ae |
|---|---|
| Name | o,p-Toluenesulfonamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 342.070799412 u |
| Formula | C14H18N2O4S2 |
| InChI | InChI=1S/2C7H9NO2S/c1-6-2-4-7(5-3-6)11(8,9)10;1-6-4-2-3-5-7(6)11(8,9)10/h2*2-5H,1H3,(H2,8,9,10) |
| InChIKey | VXGAPBLISGTEKE-UHFFFAOYSA-N |
| SMILES | NS(C1=CC=C(C=C1)C)(=O)=O.NS(C1=CC=CC=C1C)(=O)=O |