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6-(4'-FLUOROPHENYL)-4-ISOPROPYL-5-METHOXYCARBONYL-2-(METHYLTHIO)-PYRIMIDINE
SpectraBase Compound ID 27Pk9zX9ekw
InChI InChI=1S/C16H17FN2O2S/c1-9(2)13-12(15(20)21-3)14(19-16(18-13)22-4)10-5-7-11(17)8-6-10/h5-9H,1-4H3
InChIKey ZOHVECQKEABYPF-UHFFFAOYSA-N
Mol Weight 320.38 g/mol
Molecular Formula C16H17FN2O2S
Exact Mass 320.099477 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7k5sXdwP2zb
Name 6-(4'-FLUOROPHENYL)-4-ISOPROPYL-5-METHOXYCARBONYL-2-(METHYLTHIO)-PYRIMIDINE
Compound Number 4A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H17FN2O2S
InChI InChI=1S/C16H17FN2O2S/c1-9(2)13-12(15(20)21-3)14(19-16(18-13)22-4)10-5-7-11(17)8-6-10/h5-9H,1-4H3
InChIKey ZOHVECQKEABYPF-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 UWSI41076