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

*Links on SpectraBase are not permalinks.

5-nitro-o-toluenesulfonic acid, dihydrate

View entire compound with spectra: 1 NMR

5-nitro-o-toluenesulfonic acid, dihydrate
SpectraBase Compound ID JP2N1X64LgL
InChI InChI=1S/C7H7NO5S.2O/c1-5-2-3-6(8(9)10)4-7(5)14(11,12)13;;/h2-4H,1H3,(H,11,12,13);;
InChIKey LVFWOIWDBZFQEI-UHFFFAOYSA-N
Mol Weight 249.193 g/mol
Molecular Formula C7H7NO7S
Exact Mass 248.994323 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID DS6g9kSUxjv
Name 5-NITRO-o-TOLUENESULFONIC ACID, DIHYDRATE
Source of Sample Tokyo Kasei Kogyo Company, Ltd., Tokyo, Japan
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H7NO5S 2H2O
InChI InChI=1S/C7H7NO5S.2O/c1-5-2-3-6(8(9)10)4-7(5)14(11,12)13;;/h2-4H,1H3,(H,11,12,13);;
InChIKey LVFWOIWDBZFQEI-UHFFFAOYSA-N
Molecular Weight 253.23
Solvent Deuterium oxide; Reference=Dioxane Spectrometer= Varian CFT-20
Synonyms O-TOLUENESULFONIC ACID, 5-NITRO-, DI- HYDRATE