| SpectraBase Compound ID | 2kreRVUUzKX |
|---|---|
| InChI | InChI=1S/C8H6O7S.Na/c9-7(10)4-1-5(8(11)12)3-6(2-4)16(13,14)15;/h1-3H,(H,9,10)(H,11,12)(H,13,14,15);/q;+1/p-1 |
| InChIKey | YXTFRJVQOWZDPP-UHFFFAOYSA-M |
| Mol Weight | 268.17 g/mol |
| Molecular Formula | C8H5NaO7S |
| Exact Mass | 267.965368 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EQTT8sYQ7ys |
|---|---|
| Name | 5-sulfoisophthalic acid, 1-monosodium salt |
| Source of Sample | Aldrich Chemical Company, Inc., Milwaukee, Wisconsin |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H5NaO7S |
| InChI | InChI=1S/C8H6O7S.Na/c9-7(10)4-1-5(8(11)12)3-6(2-4)16(13,14)15;/h1-3H,(H,9,10)(H,11,12)(H,13,14,15);/q;+1/p-1 |
| InChIKey | YXTFRJVQOWZDPP-UHFFFAOYSA-M |
| Instrument Name | Varian A-60 |
| Sadtler NMR Number | 7420M |
| Solvent | D2O |