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HEXYLITACONIC-ACID
SpectraBase Compound ID Hd50WdynyGa
InChI InChI=1S/C11H18O4/c1-3-4-5-6-7-9(11(14)15)8(2)10(12)13/h9H,2-7H2,1H3,(H,12,13)(H,14,15)
InChIKey HKMDCNSGDQBQLI-UHFFFAOYSA-N
Mol Weight 214.26 g/mol
Molecular Formula C11H18O4
Exact Mass 214.120509 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID F5gj5IW7vjx
Name (-)-HEXYLITACONIC_ACID;2-HEXYL-3-METHYLENSUCCINIC_ACID
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H18O4
InChI InChI=1S/C11H18O4/c1-3-4-5-6-7-9(11(14)15)8(2)10(12)13/h9H,2-7H2,1H3,(H,12,13)(H,14,15)
InChIKey HKMDCNSGDQBQLI-UHFFFAOYSA-N
Literature Reference Author C.KLEMKE,S.KEHRAUS,A.D.WRIGHT,G.M.KOENIG
Literature Reference Citation J.NAT.PROD.,67,1058(2004)
Literature Reference DOI 10.1021/np034061x
Molecular Weight 214.262 g/mol
Solvent CDCl3
Source File Reference UWMZ5825