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1-(3,4-DIMETHOXYPHENYL)-ETHANESULFONIC-ACID
SpectraBase Compound ID AJaiNJ54wOr
InChI InChI=1S/C10H14O5S/c1-7(16(11,12)13)8-4-5-9(14-2)10(6-8)15-3/h4-7H,1-3H3,(H,11,12,13)
InChIKey RHMCMQJXUZOPEZ-UHFFFAOYSA-N
Mol Weight 246.28 g/mol
Molecular Formula C10H14O5S
Exact Mass 246.056195 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4hXKVYfufJa
Name 1-(3,4-DIMETHOXYPHENYL)-ETHANESULFONIC-ACID
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H14O5S
InChI InChI=1S/C10H14O5S/c1-7(16(11,12)13)8-4-5-9(14-2)10(6-8)15-3/h4-7H,1-3H3,(H,11,12,13)
InChIKey RHMCMQJXUZOPEZ-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 246.278 g/mol
Solvent CD3OD
Source File Reference UWIR17207