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2-CHLORO-4,4,5,5,6,6,7,7,7-NONAFLUORO-3-OXOHEPTANOIC ACID, METHYLESTER (KETO)
SpectraBase Compound ID 6SU3XWM4Suq
InChI InChI=1S/C8H4ClF9O3/c1-21-4(20)2(9)3(19)5(10,11)6(12,13)7(14,15)8(16,17)18/h2H,1H3
InChIKey CPKNRBVDLSVAOV-UHFFFAOYSA-N
Mol Weight 354.56 g/mol
Molecular Formula C8H4ClF9O3
Exact Mass 353.970525 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8ZUivA9CGPV
Name 2-CHLORO-4,4,5,5,6,6,7,7,7-NONAFLUORO-3-OXOHEPTANOIC ACID, METHYLESTER (KETO)
Comments C=1M, CF2 ASSIGNED (A.Y.)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C8H4ClF9O3
InChI InChI=1S/C8H4ClF9O3/c1-21-4(20)2(9)3(19)5(10,11)6(12,13)7(14,15)8(16,17)18/h2H,1H3
InChIKey CPKNRBVDLSVAOV-UHFFFAOYSA-N
Instrument Name Jeol FX-100
Literature Reference Z.E.SKRYABINA, V.I.SALOUTIN, K.I.PASHKEVICH, D.V.BAZHENOV, YU.K.GRISHIN,YU.A.USTYNYUK (1986) Izv.Akad.Nauk SSSR(Russ. Lang.): N9, 2046-2052.
NMR Standard C6F6
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3 chloroform-d