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EUPARVIC_ACID;6-(3-CARBOXYBUTYL)-5,7-DIHYDROXY-4-METHYLPHTHALAN-1-ONE
SpectraBase Compound ID 45jIcgfWACq
InChI InChI=1S/C14H16O6/c1-6(13(17)18)3-4-8-11(15)7(2)9-5-20-14(19)10(9)12(8)16/h6,15-16H,3-5H2,1-2H3,(H,17,18)/t6-/m0/s1
InChIKey LSZUJXDQMUMSLJ-LURJTMIESA-N
Mol Weight 280.28 g/mol
Molecular Formula C14H16O6
Exact Mass 280.094688 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6iLZfH54nBF
Name EUPARVIC_ACID;6-(3-CARBOXYBUTYL)-5,7-DIHYDROXY-4-METHYLPHTHALAN-1-ONE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H16O6
InChI InChI=1S/C14H16O6/c1-6(13(17)18)3-4-8-11(15)7(2)9-5-20-14(19)10(9)12(8)16/h6,15-16H,3-5H2,1-2H3,(H,17,18)/t6-/m0/s1
InChIKey LSZUJXDQMUMSLJ-LURJTMIESA-N
Literature Reference Author E.HABIB,F.LEON,J.D.BAUER,R.A.HILL,P.CARVALHO,H.G.CUTLER,S.J. CUTLER
Literature Reference Citation J.NAT.PROD.,71,1915(2008)
Literature Reference DOI 10.1021/np8003497
Molecular Weight 280.277 g/mol
Sample ID 29313
Solvent ACETONE-D6