For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
4-HYDROXY-m-TOLUENESULFONIC ACID, HYDROGEN SULFATE (ESTER)
SpectraBase Compound ID CMMSSFvqhPu
InChI InChI=1S/C7H8O7S2/c1-5-4-6(15(8,9)10)2-3-7(5)14-16(11,12)13/h2-4H,1H3,(H,8,9,10)(H,11,12,13)
InChIKey SKESCBBMPWMMEL-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

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID CFsNpvRBaMS
Name 4-HYDROXY-m-TOLUENESULFONIC ACID, HYDROGEN SULFATE (ESTER)
Source of Sample G. Strandlund, P. O. Lagerstroem Acta Chem. Scand. B 33, 261(1979)
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H8O7S2
InChI InChI=1S/C7H8O7S2/c1-5-4-6(15(8,9)10)2-3-7(5)14-16(11,12)13/h2-4H,1H3,(H,8,9,10)(H,11,12,13)
InChIKey SKESCBBMPWMMEL-UHFFFAOYSA-N
Molecular Weight 268.27
Solvent Deuterium oxide; Reference=Dioxane; Temperature=Ambient Spectrometer= Varian CFT-20
Synonyms M-TOLUENESULFONIC ACID, 4-HYDROXY-, HYDROGEN SULFATE (ESTER)