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2-[(2-INDOLYLCARBONYL)-METHYL]-5-(METHOXYCARBONYL)-1-METHYL-3-(TRICHLOROACETYL)-1,2-DIHYDROPYRIDINE
SpectraBase Compound ID 5WM6q4ZZ48M
InChI InChI=1S/C20H17Cl3N2O4/c1-25-10-12(19(28)29-2)7-13(18(27)20(21,22)23)16(25)9-17(26)15-8-11-5-3-4-6-14(11)24-15/h3-8,10,16,24H,9H2,1-2H3
InChIKey KKWOBTXELBFVHJ-UHFFFAOYSA-N
Mol Weight 455.73 g/mol
Molecular Formula C20H17Cl3N2O4
Exact Mass 454.02539 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1MJPuuXCyXD
Name 2-[(2-INDOLYLCARBONYL)-METHYL]-5-(METHOXYCARBONYL)-1-METHYL-3-(TRICHLOROACETYL)-1,2-DIHYDROPYRIDINE
Compound Number 15C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H17Cl3N2O4
InChI InChI=1S/C20H17Cl3N2O4/c1-25-10-12(19(28)29-2)7-13(18(27)20(21,22)23)16(25)9-17(26)15-8-11-5-3-4-6-14(11)24-15/h3-8,10,16,24H,9H2,1-2H3
InChIKey KKWOBTXELBFVHJ-UHFFFAOYSA-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 455.725 g/mol
Solvent DMSO-D6
Source File Reference UWMZ2722