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3-ALLYL-2,3,5,6,7,8-HEXAFLUOROQUINOLIN-4(3H)-ONE
SpectraBase Compound ID DsZnc1H44li
InChI InChI=1S/C12H5F6NO/c1-2-3-12(18)10(20)4-5(13)6(14)7(15)8(16)9(4)19-11(12)17/h2H,1,3H2
InChIKey YSLMBVJFQOGBHM-UHFFFAOYSA-N
Mol Weight 293.17 g/mol
Molecular Formula C12H5F6NO
Exact Mass 293.027533 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GRUbqExzVns
Name 3-ALLYL-2,3,5,6,7,8-HEXAFLUOROQUINOLIN-4(3H)-ONE
Comments SCALE INVERTED (DIRECT INDICATION IN THE PUBLICATION).
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H5F6NO
InChI InChI=1S/C12H5F6NO/c1-2-3-12(18)10(20)4-5(13)6(14)7(15)8(16)9(4)19-11(12)17/h2H,1,3H2
InChIKey YSLMBVJFQOGBHM-UHFFFAOYSA-N
Instrument Name Bruker AC-250
Literature Reference G.M.BROOKE, I.M.EGGLESTON, F.A.HALE (1988) J.Fluor.Chem.: v.38, N3, 421-434.
NMR Standard CCl3F
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3 chloroform-d