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2-HYDROXYTOLUENE-3,5-DISULFONIC ACID

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2-HYDROXYTOLUENE-3,5-DISULFONIC ACID
SpectraBase Compound ID DXEmIwatPfh
InChI InChI=1S/C7H8O7S2/c1-4-2-5(15(9,10)11)3-6(7(4)8)16(12,13)14/h2-3,8H,1H3,(H,9,10,11)(H,12,13,14)
InChIKey DAPUXWCGIFCHFN-UHFFFAOYSA-N
Mol Weight 268.25 g/mol
Molecular Formula C7H8O7S2
Exact Mass 267.971145 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Fct35a0UY3m
Name 4-Hydroxy-5-methyl-benzene-1,3-disulfonic acid
CAS Registry Number 71552-44-8
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C7H8O7S2
InChI InChI=1S/C7H8O7S2/c1-4-2-5(15(9,10)11)3-6(7(4)8)16(12,13)14/h2-3,8H,1H3,(H,9,10,11)(H,12,13,14)
InChIKey DAPUXWCGIFCHFN-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Literature Reference G. Strandlund, P.O. Lagerstroem, Acta Chem. Scand. B33, 261 (1979).
NMR Standard Dioxane
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent D2O