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2,3-BISTRIFLUOROMETHYL-4,4,4-TRIFLUOROBUTYRIC ACID
SpectraBase Compound ID LKJPjlv4SXj
InChI InChI=1S/C6H3F9O2/c7-4(8,9)1(3(16)17)2(5(10,11)12)6(13,14)15/h1-2H,(H,16,17)
InChIKey PTTDACWIGQSXLT-UHFFFAOYSA-N
Mol Weight 278.07 g/mol
Molecular Formula C6H3F9O2
Exact Mass 277.998933 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5nJBOqQA3jW
Name 2,3-BISTRIFLUOROMETHYL-4,4,4-TRIFLUOROBUTYRIC ACID
Comments SCALE INVERTED;R-20A (PERKIN-ELMER)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C6H3F9O2
InChI InChI=1S/C6H3F9O2/c7-4(8,9)1(3(16)17)2(5(10,11)12)6(13,14)15/h1-2H,(H,16,17)
InChIKey PTTDACWIGQSXLT-UHFFFAOYSA-N
Instrument Name SEE COMMENT
Literature Reference N.B.KAZ'MINA, G.S.KRASNIKOVA, E.P.LURIE, E.I.MYSOV, I.L.KNUNYANTS (1975)Izv.Akad.Nauk SSSR(Russ. Lang.): N11, 2525-2529.
NMR Standard -CF3COOH external
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent not reported