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3-ACETYL-1-METHYL-4-[((1-METHYL-2-INDOLYL)-CARBONYL)-METHYL]-5-(TRICHLOROACETYL)-1,4-DIHYDROPYRIDINE
SpectraBase Compound ID CpwHu9rGN55
InChI InChI=1S/C21H19Cl3N2O3/c1-12(27)15-10-25(2)11-16(20(29)21(22,23)24)14(15)9-19(28)18-8-13-6-4-5-7-17(13)26(18)3/h4-8,10-11,14H,9H2,1-3H3
InChIKey SYPVCPBQSAMPTD-UHFFFAOYSA-N
Mol Weight 453.75 g/mol
Molecular Formula C21H19Cl3N2O3
Exact Mass 452.046126 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4kCX8H6BQYC
Name 3-ACETYL-1-METHYL-4-[((1-METHYL-2-INDOLYL)-CARBONYL)-METHYL]-5-(TRICHLOROACETYL)-1,4-DIHYDROPYRIDINE
Compound Number 20B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H19Cl3N2O3
InChI InChI=1S/C21H19Cl3N2O3/c1-12(27)15-10-25(2)11-16(20(29)21(22,23)24)14(15)9-19(28)18-8-13-6-4-5-7-17(13)26(18)3/h4-8,10-11,14H,9H2,1-3H3
InChIKey SYPVCPBQSAMPTD-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 453.752 g/mol
Solvent CDCl3
Source File Reference UWMZ2729