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3-[(E)-2-(METHOXYCARBONYL)-VINYL]-1-METHYL-4-[((1-METHYL-2-INDOLYL)-CARBONYL)-METHYL]-5-(TRIFLUOROACETYL)-1,4-DIHYDROPYRIDINE

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3-[(E)-2-(METHOXYCARBONYL)-VINYL]-1-METHYL-4-[((1-METHYL-2-INDOLYL)-CARBONYL)-METHYL]-5-(TRIFLUOROACETYL)-1,4-DIHYDROPYRIDINE
SpectraBase Compound ID KvI0GFsgSP5
InChI InChI=1S/C23H21F3N2O4/c1-27-12-15(8-9-21(30)32-3)16(17(13-27)22(31)23(24,25)26)11-20(29)19-10-14-6-4-5-7-18(14)28(19)2/h4-10,12-13,16H,11H2,1-3H3/b9-8+
InChIKey MVKYZTRCPOGVPW-CMDGGOBGSA-N
Mol Weight 446.43 g/mol
Molecular Formula C23H21F3N2O4
Exact Mass 446.145342 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9KDR11c0pQr
Name 3-[(E)-2-(METHOXYCARBONYL)-VINYL]-1-METHYL-4-[((1-METHYL-2-INDOLYL)-CARBONYL)-METHYL]-5-(TRIFLUOROACETYL)-1,4-DIHYDROPYRIDINE
Compound Number 19D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H21F3N2O4
InChI InChI=1S/C23H21F3N2O4/c1-27-12-15(8-9-21(30)32-3)16(17(13-27)22(31)23(24,25)26)11-20(29)19-10-14-6-4-5-7-18(14)28(19)2/h4-10,12-13,16H,11H2,1-3H3/b9-8+
InChIKey MVKYZTRCPOGVPW-CMDGGOBGSA-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 446.426 g/mol
Solvent CDCl3
Source File Reference UWMZ2727