| SpectraBase Compound ID | jTdTuUVcRf |
|---|---|
| InChI | InChI=1S/C7H7NO5S.2H2O/c1-5-2-3-6(8(9)10)4-7(5)14(11,12)13;;/h2-4H,1H3,(H,11,12,13);2*1H2 |
| InChIKey | DQVSVPYCTFCYLW-UHFFFAOYSA-N |
| Mol Weight | 253.22 g/mol |
| Molecular Formula | C7H11NO7S |
| Exact Mass | 253.025623 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IRW8V8kO5x9 |
|---|---|
| Name | 5-nitro-o-toluenesulfonic acid, dihydrate |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H11NO7S |
| InChI | InChI=1S/C7H7NO5S.2H2O/c1-5-2-3-6(8(9)10)4-7(5)14(11,12)13;;/h2-4H,1H3,(H,11,12,13);2*1H2 |
| InChIKey | DQVSVPYCTFCYLW-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 40318M |
| Solvent | Polysol |