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8'-METHYLCONSTICTIC-ACID

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8'-METHYLCONSTICTIC-ACID
SpectraBase Compound ID 7vfJ9pq9ZSd
InChI InChI=1S/C20H16O10/c1-7-4-10(26-2)8(5-21)15-11(7)18(24)29-16-9(6-22)14(23)12-13(17(16)28-15)20(27-3)30-19(12)25/h4-5,20,22-23H,6H2,1-3H3
InChIKey TYPBTTCDWIAKJV-UHFFFAOYSA-N
Mol Weight 416.34 g/mol
Molecular Formula C20H16O10
Exact Mass 416.074347 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9sGnvPeWKw5
Name 8'-METHYLCONSTICTIC-ACID
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H16O10
InChI InChI=1S/C20H16O10/c1-7-4-10(26-2)8(5-21)15-11(7)18(24)29-16-9(6-22)14(23)12-13(17(16)28-15)20(27-3)30-19(12)25/h4-5,20,22-23H,6H2,1-3H3
InChIKey TYPBTTCDWIAKJV-UHFFFAOYSA-N
Literature Reference Author P.PAPADOPOULOU,O.TZAKOU,C.VAGIAS,P.KEFALAS,V.ROUSSIS
Literature Reference Citation MOLECULES,12,997(2007)
Literature Reference DOI 10.3390/12050997
Molecular Weight 416.341 g/mol
Sample ID 46380
Solvent CDCl3:CD3OD=1:2