| SpectraBase Compound ID | 5DJg4HwvWkk |
|---|---|
| InChI | InChI=1S/C8H10O3S.2H2O/c1-6-3-4-8(7(2)5-6)12(9,10)11;;/h3-5H,1-2H3,(H,9,10,11);2*1H2 |
| InChIKey | PCMSCWFZBHVERE-UHFFFAOYSA-N |
| Mol Weight | 222.255 g/mol |
| Molecular Formula | C8H14O5S |
| Exact Mass | 222.056195 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FmpZzgSTCXb |
|---|---|
| Name | 2,4-xylenesulfonic acid, dihydrate |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H14O5S |
| InChI | InChI=1S/C8H10O3S.2H2O/c1-6-3-4-8(7(2)5-6)12(9,10)11;;/h3-5H,1-2H3,(H,9,10,11);2*1H2 |
| InChIKey | PCMSCWFZBHVERE-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 27048M |
| Solvent | Polysol |