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3-(4-HYDROXY-3,4-DIMETHOXYPHENYL)-3-SULFOPROPANOIC-ACID
SpectraBase Compound ID Bc6Bw7T1yep
InChI InChI=1S/C11H14O8S/c1-18-7-3-6(4-8(19-2)11(7)14)9(5-10(12)13)20(15,16)17/h3-4,9,14H,5H2,1-2H3,(H,12,13)(H,15,16,17)
InChIKey MIXFSDCOVRRZHN-UHFFFAOYSA-N
Mol Weight 306.29 g/mol
Molecular Formula C11H14O8S
Exact Mass 306.040939 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6yq7PefizfL
Name 3-(4-HYDROXY-3,4-DIMETHOXYPHENYL)-3-SULFOPROPANOIC-ACID
Compound Number 11
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H14O8S
InChI InChI=1S/C11H14O8S/c1-18-7-3-6(4-8(19-2)11(7)14)9(5-10(12)13)20(15,16)17/h3-4,9,14H,5H2,1-2H3,(H,12,13)(H,15,16,17)
InChIKey MIXFSDCOVRRZHN-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 306.287 g/mol
Solvent CD3OD
Source File Reference UWIR17221