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ETHYL-ALPHA-FLUORO-ALPHA-[4-(7-(TRIFLUOROMETHYL)-QUINOLYL)-THIO]-ACETATE
SpectraBase Compound ID EPLDRp2a68p
InChI InChI=1S/C14H11F4NO2S/c1-2-21-13(20)12(15)22-11-5-6-19-10-7-8(14(16,17)18)3-4-9(10)11/h3-7,12H,2H2,1H3
InChIKey VRGNHMIPFZHOHL-UHFFFAOYSA-N
Mol Weight 333.3 g/mol
Molecular Formula C14H11F4NO2S
Exact Mass 333.044662 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID L4cZXbsu8VX
Name ETHYL-ALPHA-FLUORO-ALPHA-[4-(7-(TRIFLUOROMETHYL)-QUINOLYL)-THIO]-ACETATE
Compound Number 5B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H11F4NO2S
InChI InChI=1S/C14H11F4NO2S/c1-2-21-13(20)12(15)22-11-5-6-19-10-7-8(14(16,17)18)3-4-9(10)11/h3-7,12H,2H2,1H3
InChIKey VRGNHMIPFZHOHL-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
Solvent CDCl3
Source File Reference UWSI39190