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Sodium 3,5-dicarboxybenzenesulfonate

View entire compound with spectra: 4 NMR, 4 FTIR, 1 Raman, and 1 UV-Vis

Sodium 3,5-dicarboxybenzenesulfonate
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

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JRw4YfEVdrn
Name 5-SULFOISOPHTHALIC ACID, 1-SODIUM SALT
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Copyright Copyright © 1980, 1981-2024 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
Melting Point >310C
Molecular Weight 268.18
Solvent Deuterium oxide; Reference=Dioxane Spectrometer= Varian CFT-20
Synonyms ISOPHTHALIC ACID, 5-SULFO-, 1-MONOSODIUM SALT