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2,4-xylenesulfonic acid, dihydrate
SpectraBase Compound ID 5DJg4HwvWkk
InChI InChI=1S/C8H10O3S.2H2O/c1-6-3-4-8(7(2)5-6)12(9,10)11;;/h3-5H,1-2H3,(H,9,10,11);2*1H2
InChIKey PCMSCWFZBHVERE-UHFFFAOYSA-N
Mol Weight 222.255 g/mol
Molecular Formula C8H14O5S
Exact Mass 222.056195 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FmpZzgSTCXb
Name 2,4-xylenesulfonic acid, dihydrate
Copyright Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H14O5S
InChI InChI=1S/C8H10O3S.2H2O/c1-6-3-4-8(7(2)5-6)12(9,10)11;;/h3-5H,1-2H3,(H,9,10,11);2*1H2
InChIKey PCMSCWFZBHVERE-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Sadtler NMR Number 27048M
Solvent Polysol