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PERFLUORO-ALPHA-KETOHEXANOIC ACID, HYDRATE
SpectraBase Compound ID DiBLkF8WEq4
InChI InChI=1S/C6H3F9O4/c7-3(8,2(18,19)1(16)17)4(9,10)5(11,12)6(13,14)15/h18-19H,(H,16,17)
InChIKey HGMXEQNXCJOQBQ-UHFFFAOYSA-N
Mol Weight 310.07 g/mol
Molecular Formula C6H3F9O4
Exact Mass 309.988762 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID kjHjlHocei
Name PERFLUORO-ALPHA-KETOHEXANOIC ACID, HYDRATE
Comments SCALE INVERTED;RS-56 (RUSSIAN)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C6H3F9O4
InChI InChI=1S/C6H3F9O4/c7-3(8,2(18,19)1(16)17)4(9,10)5(11,12)6(13,14)15/h18-19H,(H,16,17)
InChIKey HGMXEQNXCJOQBQ-UHFFFAOYSA-N
Instrument Name SEE COMMENT
Literature Reference V.I.SALOUTIN, I.A.PITERSKIKH, K.I.PASHKEVICH, M.I.KODESS, I.YA.POSTOVOI (1980)Izv.Akad.Nauk SSSR(Russ. Lang.): N10, 2403-2406.
NMR Standard -CF3COOH external
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent C3D6O acetone-d6