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4-[(2-INDOLYLCARBONYL)-METHYL]-3-[(E)-2-(METHOXYCARBONYL)-VINYL]-1-METHYL-5-(TRICHLOROACETYL)-1,4-DIHYDROPYRIDINE
SpectraBase Compound ID 653TH1NAZh2
InChI InChI=1S/C22H19Cl3N2O4/c1-27-11-14(7-8-20(29)31-2)15(16(12-27)21(30)22(23,24)25)10-19(28)18-9-13-5-3-4-6-17(13)26-18/h3-9,11-12,15,26H,10H2,1-2H3/b8-7+
InChIKey KZQGZWUMIGZGME-BQYQJAHWSA-N
Mol Weight 481.76 g/mol
Molecular Formula C22H19Cl3N2O4
Exact Mass 480.04104 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4EberQLop2G
Name 4-[(2-INDOLYLCARBONYL)-METHYL]-3-[(E)-2-(METHOXYCARBONYL)-VINYL]-1-METHYL-5-(TRICHLOROACETYL)-1,4-DIHYDROPYRIDINE
Compound Number 21D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H19Cl3N2O4
InChI InChI=1S/C22H19Cl3N2O4/c1-27-11-14(7-8-20(29)31-2)15(16(12-27)21(30)22(23,24)25)10-19(28)18-9-13-5-3-4-6-17(13)26-18/h3-9,11-12,15,26H,10H2,1-2H3/b8-7+
InChIKey KZQGZWUMIGZGME-BQYQJAHWSA-N
Literature Reference Author M.L.BENNASAR,B.VIDAL,J.BOSCH
Literature Reference Citation J.ORG.CHEM.,60,4280(1995)
Literature Reference DOI 10.1021/jo00118a055
Molecular Weight 481.763 g/mol
Solvent DMSO-D6
Source File Reference UWMZ2735