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METHYL-SINAPOYL-MALATE
SpectraBase Compound ID 22GW3b4AdU4
InChI InChI=1S/C16H18O9/c1-22-10-6-9(7-11(23-2)15(10)20)4-5-14(19)25-12(8-13(17)18)16(21)24-3/h4-7,12,20H,8H2,1-3H3,(H,17,18)/b5-4+
InChIKey UBQMBIFYXNOHMG-SNAWJCMRSA-N
Mol Weight 354.31 g/mol
Molecular Formula C16H18O9
Exact Mass 354.095082 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LgZumqDQU5V
Name METHYL-SINAPOYL-MALATE
Compound Number 14H
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H18O9
InChI InChI=1S/C16H18O9/c1-22-10-6-9(7-11(23-2)15(10)20)4-5-14(19)25-12(8-13(17)18)16(21)24-3/h4-7,12,20H,8H2,1-3H3,(H,17,18)/b5-4+
InChIKey UBQMBIFYXNOHMG-SNAWJCMRSA-N
Literature Reference Author M.S.C.PEDRAS,Q.A.ZHENG,R.S.GADAGI,S.R.RIMMER
Literature Reference Citation PHYTOCHEM.,69,894(2008)
Literature Reference DOI 10.1016/j.phytochem.2007.10.019
Molecular Weight 354.314 g/mol
Sample ID 43220
Solvent D2O