| SpectraBase Compound ID | HeDll0gj6V0 |
|---|---|
| InChI | InChI=1S/C14H13NO4S/c1-10-2-8-13(9-3-10)20(18,19)15-12-6-4-11(5-7-12)14(16)17/h2-9,15H,1H3,(H,16,17) |
| InChIKey | ZEUVKKKFDVRMIM-UHFFFAOYSA-N |
| Mol Weight | 291.32 g/mol |
| Molecular Formula | C14H13NO4S |
| Exact Mass | 291.056529 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | APTvggFGXlc |
|---|---|
| Name | 4-(p-Toluenesulfonamido)benzoic acid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 291.056529073 u |
| Formula | C14H13NO4S |
| InChI | InChI=1S/C14H13NO4S/c1-10-2-8-13(9-3-10)20(18,19)15-12-6-4-11(5-7-12)14(16)17/h2-9,15H,1H3,(H,16,17) |
| InChIKey | ZEUVKKKFDVRMIM-UHFFFAOYSA-N |
| SMILES | CC1=CC=C(S(=O)(=O)NC2=CC=C(C(=O)O)C=C2)C=C1 |