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3-(3,4-DIMETHOXYPHENYL)-3-SULFOPROPANOIC-ACID
SpectraBase Compound ID 8lBvW5iScE3
InChI InChI=1S/C11H14O7S/c1-17-8-4-3-7(5-9(8)18-2)10(6-11(12)13)19(14,15)16/h3-5,10H,6H2,1-2H3,(H,12,13)(H,14,15,16)
InChIKey ZSMOWYSJZRXEAO-UHFFFAOYSA-N
Mol Weight 290.29 g/mol
Molecular Formula C11H14O7S
Exact Mass 290.046024 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 876BVzIpAhQ
Name 3-(3,4-DIMETHOXYPHENYL)-3-SULFOPROPANOIC-ACID
Compound Number 9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H14O7S
InChI InChI=1S/C11H14O7S/c1-17-8-4-3-7(5-9(8)18-2)10(6-11(12)13)19(14,15)16/h3-5,10H,6H2,1-2H3,(H,12,13)(H,14,15,16)
InChIKey ZSMOWYSJZRXEAO-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 290.288 g/mol
Solvent CD3OD
Source File Reference UWIR17217