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1-FLUORO-1-[4-(7-(TRIFLUOROMETHYL)-QUINOLYL)-THIO]-2-PROPANONE
SpectraBase Compound ID KuApyHRwgZN
InChI InChI=1S/C13H9F4NOS/c1-7(19)12(14)20-11-4-5-18-10-6-8(13(15,16)17)2-3-9(10)11/h2-6,12H,1H3
InChIKey KLYSYDSZWSDPSV-UHFFFAOYSA-N
Mol Weight 303.27 g/mol
Molecular Formula C13H9F4NOS
Exact Mass 303.034098 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5zskmatVHxu
Name 1-FLUORO-1-[4-(7-(TRIFLUOROMETHYL)-QUINOLYL)-THIO]-2-PROPANONE
Compound Number 5A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H9F4NOS
InChI InChI=1S/C13H9F4NOS/c1-7(19)12(14)20-11-4-5-18-10-6-8(13(15,16)17)2-3-9(10)11/h2-6,12H,1H3
InChIKey KLYSYDSZWSDPSV-UHFFFAOYSA-N
Literature Reference Author K.M.DAWOOD,T.FUCHIGAMI
Literature Reference Citation J.ORG.CHEM.,64,138(1999)
Literature Reference DOI 10.1021/jo981476s
Molecular Weight 303.274 g/mol
Sample ID 39189
Solvent CDCl3