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3-OXO-4,4,5,5,6,6,6-HEPTAFLUOROHEXANOIC ACID, METHYL ESTER (ENOL)
SpectraBase Compound ID Ks7m8jaVMr6
InChI InChI=1S/C7H5F7O3/c1-17-4(16)2-3(15)5(8,9)6(10,11)7(12,13)14/h2,15H,1H3/b3-2-
InChIKey MCIHNRRGVNBYIL-IHWYPQMZSA-N
Mol Weight 270.1 g/mol
Molecular Formula C7H5F7O3
Exact Mass 270.012691 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2StjBQYCADA
Name 3-OXO-4,4,5,5,6,6,6-HEPTAFLUOROHEXANOIC ACID, METHYL ESTER (ENOL)
Comments C=1M, CF2 ASSIGNED (A.Y.)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C7H5F7O3
InChI InChI=1S/C7H5F7O3/c1-17-4(16)2-3(15)5(8,9)6(10,11)7(12,13)14/h2,15H,1H3/b3-2-
InChIKey MCIHNRRGVNBYIL-IHWYPQMZSA-N
Instrument Name Jeol FX-100
Literature Reference A.N.FOMIN, V.I.SALOUTIN, K.I.PASHKEVICH, D.V.BAZHENOV, YU.K.GRISHIN,YU.A.USTYNYUK (1983) Izv.Akad.Nauk SSSR(Russ. Lang.): N11, 2626-2632.
NMR Standard C6F6
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent C3D6O acetone-d6