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3-CYANO-1-METHYL-2-[((1-METHYL-2-INDOLYL)-CARBONYL)-METHYL]-5-(TRIFLUOROACETYL)-1,2-DIHYDROPYRIDINE
SpectraBase Compound ID BUNq8XC4bKR
InChI InChI=1S/C20H16F3N3O2/c1-25-11-14(19(28)20(21,22)23)7-13(10-24)16(25)9-18(27)17-8-12-5-3-4-6-15(12)26(17)2/h3-8,11,16H,9H2,1-2H3
InChIKey CPLUGRFQCMPWMT-UHFFFAOYSA-N
Mol Weight 387.36 g/mol
Molecular Formula C20H16F3N3O2
Exact Mass 387.119461 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7eURGTRpAtC
Name 3-CYANO-1-METHYL-2-[((1-METHYL-2-INDOLYL)-CARBONYL)-METHYL]-5-(TRIFLUOROACETYL)-1,2-DIHYDROPYRIDINE
Compound Number 16E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H16F3N3O2
InChI InChI=1S/C20H16F3N3O2/c1-25-11-14(19(28)20(21,22)23)7-13(10-24)16(25)9-18(27)17-8-12-5-3-4-6-15(12)26(17)2/h3-8,11,16H,9H2,1-2H3
InChIKey CPLUGRFQCMPWMT-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 387.361 g/mol
Solvent CDCl3
Source File Reference UWMZ2721