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4-HYDROXY-3-METHOXYPHENYL-METHANESULFONIC-ACID

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4-HYDROXY-3-METHOXYPHENYL-METHANESULFONIC-ACID
SpectraBase Compound ID GkCLlW0vp15
InChI InChI=1S/C8H10O5S/c1-13-8-4-6(2-3-7(8)9)5-14(10,11)12/h2-4,9H,5H2,1H3,(H,10,11,12)
InChIKey ZDHUVXNKTFAHHC-UHFFFAOYSA-N
Mol Weight 218.22 g/mol
Molecular Formula C8H10O5S
Exact Mass 218.024895 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IXK35PpGTtt
Name 4-HYDROXY-3-METHOXYPHENYL-METHANESULFONIC-ACID
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H10O5S
InChI InChI=1S/C8H10O5S/c1-13-8-4-6(2-3-7(8)9)5-14(10,11)12/h2-4,9H,5H2,1H3,(H,10,11,12)
InChIKey ZDHUVXNKTFAHHC-UHFFFAOYSA-N
Literature Reference Author B.L.LUTNAES,B.O.MYRVOLD,R.A.LAUTEN,M.M.ENDESHAW
Literature Reference Citation MAGN.RES.CHEM.,46,299(2008)
Literature Reference DOI 10.1002/mrc.2184
Molecular Weight 218.224 g/mol
Solvent D2O
Source File Reference UWIR17201