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ALPHA-HYDRO-BETA-CHLOROPENTAFLUOROISOBUTYRIC ACID, METHYL ESTER
SpectraBase Compound ID 2bQqesw0WxV
InChI InChI=1S/C5H4ClF5O2/c1-13-3(12)2(4(6,7)8)5(9,10)11/h2H,1H3
InChIKey CQEWSCYMXKYCBY-UHFFFAOYSA-N
Mol Weight 226.53 g/mol
Molecular Formula C5H4ClF5O2
Exact Mass 225.981998 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7BHt7PGMIs8
Name ALPHA-HYDRO-BETA-CHLOROPENTAFLUOROISOBUTYRIC ACID, METHYL ESTER
Comments SCALE INVERTED;H-60 (HITACHI)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C5H4ClF5O2
InChI InChI=1S/C5H4ClF5O2/c1-13-3(12)2(4(6,7)8)5(9,10)11/h2H,1H3
InChIKey CQEWSCYMXKYCBY-UHFFFAOYSA-N
Instrument Name SEE COMMENT
Literature Reference U.UTEBAEV, E.M.ROKHLIN, E.P.LUR'E (1976) Izv.Akad.Nauk SSSR(Russ. Lang.): N1,142-148.
NMR Standard -CF3COOH
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent C2H3N acetonitrile