| SpectraBase Compound ID | 488ZcLhSwNS |
|---|---|
| InChI | InChI=1S/C7H6O5S.Na/c8-7(9)5-1-3-6(4-2-5)13(10,11)12;/h1-4H,(H,8,9)(H,10,11,12);/q;+1/p-1 |
| InChIKey | NUERUBQHXIQIOB-UHFFFAOYSA-M |
| Mol Weight | 224.16176928 g/mol |
| Molecular Formula | C7H5NaO5S |
| Exact Mass | 223.975539 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6IFTiFcMEDg |
|---|---|
| Name | p-SULFOBENZOIC ACID, MONOSODIUM SALT |
| Source of Sample | Aldrich Chemical Company, Inc., Milwaukee, Wisconsin |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H5NaO5S |
| InChI | InChI=1S/C7H6O5S.Na/c8-7(9)5-1-3-6(4-2-5)13(10,11)12;/h1-4H,(H,8,9)(H,10,11,12);/q;+1/p-1 |
| InChIKey | NUERUBQHXIQIOB-UHFFFAOYSA-M |
| Molecular Weight | 224.17 |
| Solvent | Dimethyl sulfoxide-d6; Reference=TMS Spectrometer= Bruker AC-300 |