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diethyl-[5-[1-(4-fluorophenyl)-6,7-dimethoxy-3-methyl-isoquinolin-2-ium-2-yl]-1,2-diaza-4-azanidacyclopenta-2,5-dien-3-yl]amine

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diethyl-[5-[1-(4-fluorophenyl)-6,7-dimethoxy-3-methyl-isoquinolin-2-ium-2-yl]-1,2-diaza-4-azanidacyclopenta-2,5-dien-3-yl]amine
SpectraBase Compound ID 5rgA52OnB0d
InChI InChI=1S/C24H26FN5O2/c1-6-29(7-2)23-26-24(28-27-23)30-15(3)12-17-13-20(31-4)21(32-5)14-19(17)22(30)16-8-10-18(25)11-9-16/h8-14H,6-7H2,1-5H3
InChIKey JJZVGCFJFCETPW-UHFFFAOYSA-N
Mol Weight 435.5 g/mol
Molecular Formula C24H26FN5O2
Exact Mass 435.207053 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JEy2OHLFwfa
Name diethyl-[5-[1-(4-fluorophenyl)-6,7-dimethoxy-3-methyl-isoquinolin-2-ium-2-yl]-1,2-diaza-4-azanidacyclopenta-2,5-dien-3-yl]amine
Compound Number 8/25
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C24H26FN5O2
InChI InChI=1S/C24H26FN5O2/c1-6-29(7-2)23-26-24(28-27-23)30-15(3)12-17-13-20(31-4)21(32-5)14-19(17)22(30)16-8-10-18(25)11-9-16/h8-14H,6-7H2,1-5H3
InChIKey JJZVGCFJFCETPW-UHFFFAOYSA-N
Literature Reference Author I.PRAUDA,I.KOEVESDI,P.TRINKA,J.REITER
Literature Reference Citation J.HETCYCL.CHEM.,38,403(2001)
Literature Reference DOI 10.1002/jhet.5570380215
Molecular Weight 435.501 g/mol
Solvent CDCl3
Source File Reference UWLU21163