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1-(2-CARBOXY3,4-METHYLENEDIOXYPHENYLCARBONYL)-6,7-DIMETHOXYISOQUINOLINE;FUMAFLORINE
SpectraBase Compound ID CPYABd36nZY
InChI InChI=1S/C20H15NO7/c1-25-14-7-10-5-6-21-17(12(10)8-15(14)26-2)18(22)11-3-4-13-19(28-9-27-13)16(11)20(23)24/h3-8H,9H2,1-2H3,(H,23,24)
InChIKey RIRBRHSYPZRZKV-UHFFFAOYSA-N
Mol Weight 381.34 g/mol
Molecular Formula C20H15NO7
Exact Mass 381.084852 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7rjVAWYpzO5
Name 1-(2-CARBOXY3,4-METHYLENEDIOXYPHENYLCARBONYL)-6,7-DIMETHOXYISOQUINOLINE;FUMAFLORINE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H15NO7
InChI InChI=1S/C20H15NO7/c1-25-14-7-10-5-6-21-17(12(10)8-15(14)26-2)18(22)11-3-4-13-19(28-9-27-13)16(11)20(23)24/h3-8H,9H2,1-2H3,(H,23,24)
InChIKey RIRBRHSYPZRZKV-UHFFFAOYSA-N
Literature Reference Author E.TABORSKA,H.BOCHORAKOVA,J.SOUSEK,P.SEDMERA,V.HAVLICEK,V.SIM ANEK
Literature Reference Citation HETEROCYCLES,45,817(1997)
Literature Reference DOI 10.3987/COM-97-7756
Molecular Weight 381.342 g/mol
Solvent CD3OD
Source File Reference UWCP8412