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1-HYDROXY-2-(1'-HEPTAFLUOROCYCLOBUTYLHEXAFLUOROCYCLOBUTYL)-4,4-DIFLUOROCYCLOBUTEN-3-ONE
SpectraBase Compound ID K5LGUR5S3E
InChI InChI=1S/C12HF15O2/c13-4(14)2(28)1(3(4)29)5(7(16,17)11(24,25)8(5,18)19)6(15)9(20,21)12(26,27)10(6,22)23/h28H
InChIKey XTQOVOZFQABTOT-UHFFFAOYSA-N
Mol Weight 462.11 g/mol
Molecular Formula C12HF15O2
Exact Mass 461.973702 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1y3pr7EcfgU
Name 1-HYDROXY-2-(1'-HEPTAFLUOROCYCLOBUTYLHEXAFLUOROCYCLOBUTYL)-4,4-DIFLUOROCYCLOBUTEN-3-ONE
Comments SCALE INVERTED, RANGE -115...-137PPM FOR CF2
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12HF15O2
InChI InChI=1S/C12HF15O2/c13-4(14)2(28)1(3(4)29)5(7(16,17)11(24,25)8(5,18)19)6(15)9(20,21)12(26,27)10(6,22)23/h28H
InChIKey XTQOVOZFQABTOT-UHFFFAOYSA-N
Instrument Name Varian A56/60A
Literature Reference R.D.CHAMBERS, G.TAYLOR, R.L.POWELL (1980) J.Fluor.Chem.: v.16, N2, 161-181.
NMR Standard CCl3F
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent D2O deuterium oxide