| SpectraBase Compound ID | BETIeYFrjUA |
|---|---|
| InChI | InChI=1S/C7H8O3S.H2O/c1-6-2-4-7(5-3-6)11(8,9)10;/h2-5H,1H3,(H,8,9,10);1H2 |
| InChIKey | KJIFKLIQANRMOU-UHFFFAOYSA-N |
| Mol Weight | 190.213 g/mol |
| Molecular Formula | C7H10O4S |
| Exact Mass | 190.02998 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7fW1u7el6Wu |
|---|---|
| Name | p-TOLUENESULFONIC ACID, MONOHYDRATE |
| Source of Sample | E. Merck AG, Darmstadt, Germany |
| Copyright | Copyright © 1980, 1981-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H8O3S H2O |
| InChI | InChI=1S/C7H8O3S.H2O/c1-6-2-4-7(5-3-6)11(8,9)10;/h2-5H,1H3,(H,8,9,10);1H2 |
| InChIKey | KJIFKLIQANRMOU-UHFFFAOYSA-N |
| Melting Point | 102-104C |
| Molecular Weight | 190.22 |
| Solvent | Polysol; Reference=TMS Spectrometer= Varian CFT-20 |
| Synonyms | P-TOLUENESULFONIC ACID, HYDRATE |