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3-TRIFLUOROMETHYL-4,4,4-TRIFLUOROBUTYRIC ACID
SpectraBase Compound ID FyMcgdH3ARs
InChI InChI=1S/C5H4F6O2/c6-4(7,8)2(1-3(12)13)5(9,10)11/h2H,1H2,(H,12,13)
InChIKey BXOJQJKUSQRUKV-UHFFFAOYSA-N
Mol Weight 210.08 g/mol
Molecular Formula C5H4F6O2
Exact Mass 210.011548 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6KD74wTbmEC
Name 3-TRIFLUOROMETHYL-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 C5H4F6O2
InChI InChI=1S/C5H4F6O2/c6-4(7,8)2(1-3(12)13)5(9,10)11/h2H,1H2,(H,12,13)
InChIKey BXOJQJKUSQRUKV-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