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4-[(2-carbomethoxy-6-diethylamino-5-methyl-3-phenyl-4-pyridyl)disulfanyl]-6-diethylamino-5-methyl-3-phenyl-picolinic acid methyl ester

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4-[(2-carbomethoxy-6-diethylamino-5-methyl-3-phenyl-4-pyridyl)disulfanyl]-6-diethylamino-5-methyl-3-phenyl-picolinic acid methyl ester
SpectraBase Compound ID IXKPmytX1Fg
InChI InChI=1S/C36H42N4O4S2/c1-9-39(10-2)33-23(5)31(27(25-19-15-13-16-20-25)29(37-33)35(41)43-7)45-46-32-24(6)34(40(11-3)12-4)38-30(36(42)44-8)28(32)26-21-17-14-18-22-26/h13-22H,9-12H2,1-8H3
InChIKey BJCOXODVZDGTRL-UHFFFAOYSA-N
Mol Weight 658.9 g/mol
Molecular Formula C36H42N4O4S2
Exact Mass 658.264748 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID n2qy7AxV8H
Name 4-[(2-carbomethoxy-6-diethylamino-5-methyl-3-phenyl-4-pyridyl)disulfanyl]-6-diethylamino-5-methyl-3-phenyl-picolinic acid methyl ester
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C36H42N4O4S2
InChI InChI=1S/C36H42N4O4S2/c1-9-39(10-2)33-23(5)31(27(25-19-15-13-16-20-25)29(37-33)35(41)43-7)45-46-32-24(6)34(40(11-3)12-4)38-30(36(42)44-8)28(32)26-21-17-14-18-22-26/h13-22H,9-12H2,1-8H3
InChIKey BJCOXODVZDGTRL-UHFFFAOYSA-N
Literature Reference Author E.PELAEZ-ARANGO,F.LOPEZ-ORTIZ,J.BARLUENGA,M.FERRERO,F.PALACI OS
Literature Reference Citation MAGN.RES.CHEM.,32,646(1994)
Literature Reference DOI 10.1002/mrc.1260321103
Molecular Weight 658.874 g/mol
Solvent CDCl3
Source File Reference UWGE278