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5-ETHOXYCARBONYL-6-(4'-FLUOROPHENYL)-4-ISOPROPYL-2-(METHYLAMINO)-1,4-DIHYDROPYRIMIDINE
SpectraBase Compound ID 6ml5dZLLXxj
InChI InChI=1S/C17H22FN3O2/c1-5-23-16(22)13-14(10(2)3)20-17(19-4)21-15(13)11-6-8-12(18)9-7-11/h6-10,14H,5H2,1-4H3,(H2,19,20,21)
InChIKey JTXOTDJQFWHXEA-UHFFFAOYSA-N
Mol Weight 319.38 g/mol
Molecular Formula C17H22FN3O2
Exact Mass 319.169605 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9CwDUtZFKWm
Name 5-ETHOXYCARBONYL-6-(4'-FLUOROPHENYL)-4-ISOPROPYL-2-(METHYLAMINO)-1,4-DIHYDROPYRIMIDINE
Compound Number 3F
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H22FN3O2
InChI InChI=1S/C17H22FN3O2/c1-5-23-16(22)13-14(10(2)3)20-17(19-4)21-15(13)11-6-8-12(18)9-7-11/h6-10,14H,5H2,1-4H3,(H2,19,20,21)
InChIKey JTXOTDJQFWHXEA-UHFFFAOYSA-N
Literature Reference Author K.YAMAMOTO,Y.G.CHEN,F.G.BUONO
Literature Reference Citation ORG.LETTERS,7,4673(2005)
Literature Reference DOI 10.1021/ol051879w
Solvent CDCl3
Source File Reference UWSI41074