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2-[[4-chloro-3-(trifluoromethyl)benzyl]carbamoyl]-5-fluoro-3,6-dihydro-2H-pyridine-1-carboxylic acid tert-butyl ester
SpectraBase Compound ID Ff0SAOXiWXy
InChI InChI=1S/C19H21ClF4N2O3/c1-18(2,3)29-17(28)26-10-12(21)5-7-15(26)16(27)25-9-11-4-6-14(20)13(8-11)19(22,23)24/h4-6,8,15H,7,9-10H2,1-3H3,(H,25,27)
InChIKey FSLVUISJNUMWLK-UHFFFAOYSA-N
Mol Weight 436.83 g/mol
Molecular Formula C19H21ClF4N2O3
Exact Mass 436.117683 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FUDJs7l4zBa
Name 2-[[4-chloro-3-(trifluoromethyl)benzyl]carbamoyl]-5-fluoro-3,6-dihydro-2H-pyridine-1-carboxylic acid tert-butyl ester
Compound Number 42
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H21ClF4N2O3
InChI InChI=1S/C19H21ClF4N2O3/c1-18(2,3)29-17(28)26-10-12(21)5-7-15(26)16(27)25-9-11-4-6-14(20)13(8-11)19(22,23)24/h4-6,8,15H,7,9-10H2,1-3H3,(H,25,27)
InChIKey FSLVUISJNUMWLK-UHFFFAOYSA-N
Literature Reference Author V.D.MATTEIS,F.L.V.DELFT,J.TIEBES,F.P.J.T.RUTJES
Literature Reference Citation EUR.J.ORG.CHEM.,1166(2006)
Molecular Weight 436.834 g/mol
Sample ID 31981
Solvent CDCl3