| SpectraBase Compound ID | 3qBChbUWFoA |
|---|---|
| InChI | InChI=1S/C8H8O4S/c1-13(11,12)7-4-2-6(3-5-7)8(9)10/h2-5H,1H3,(H,9,10) |
| InChIKey | AJBWNNKDUMXZLM-UHFFFAOYSA-N |
| Mol Weight | 200.21 g/mol |
| Molecular Formula | C8H8O4S |
| Exact Mass | 200.01433 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1GL4PptRA5R |
|---|---|
| Name | p-(methylsulfonyl)benzoic acid |
| Source of Sample | Aldrich Chemical Company, Inc., Milwaukee, Wisconsin |
| Copyright | Copyright © 2009-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H8O4S |
| InChI | InChI=1S/C8H8O4S/c1-13(11,12)7-4-2-6(3-5-7)8(9)10/h2-5H,1H3,(H,9,10) |
| InChIKey | AJBWNNKDUMXZLM-UHFFFAOYSA-N |
| Instrument Name | Varian A-60 |
| Sadtler NMR Number | 5856M |
| Solvent | DMSO-d6 |
| Synonyms | BENZOIC ACID, P-/METHYLSULFONYL/-, |