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MALONIC_ACID_3,4-DIHYDROXYPHENYLETHYL_MONOESTER

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MALONIC_ACID_3,4-DIHYDROXYPHENYLETHYL_MONOESTER
SpectraBase Compound ID 6Ao7qOPZL62
InChI InChI=1S/C11H12O6/c12-8-2-1-7(5-9(8)13)3-4-17-11(16)6-10(14)15/h1-2,5,12-13H,3-4,6H2,(H,14,15)
InChIKey SAFHLGONVNACBW-UHFFFAOYSA-N
Mol Weight 240.21 g/mol
Molecular Formula C11H12O6
Exact Mass 240.063388 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4zQIXdEqJiU
Name MALONIC_ACID_3,4-DIHYDROXYPHENYLETHYL_MONOESTER
Compound Number 1C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H12O6
InChI InChI=1S/C11H12O6/c12-8-2-1-7(5-9(8)13)3-4-17-11(16)6-10(14)15/h1-2,5,12-13H,3-4,6H2,(H,14,15)
InChIKey SAFHLGONVNACBW-UHFFFAOYSA-N
Literature Reference Author Z.ZHANG,B.XIAO,Q.CHEN,X.Y.LIAN
Literature Reference Citation J.NAT.PROD.,73,252(2010)
Literature Reference DOI 10.1021/np900519d
Molecular Weight 240.213 g/mol
Sample ID 34493
Solvent CD3OD