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BETA,BETA,GAMMA,GAMMA,GAMMA-PENTAFLUORO-ALPHA-KETOBUTANOIC ACID,HYDRATE
SpectraBase Compound ID 4D37dy5x4O2
InChI InChI=1S/C4H3F5O4/c5-3(6,4(7,8)9)2(12,13)1(10)11/h12-13H,(H,10,11)
InChIKey JBXUVKGIGNHZQT-UHFFFAOYSA-N
Mol Weight 210.06 g/mol
Molecular Formula C4H3F5O4
Exact Mass 209.995149 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1G0BB4rtL4m
Name BETA,BETA,GAMMA,GAMMA,GAMMA-PENTAFLUORO-ALPHA-KETOBUTANOIC ACID,HYDRATE
Comments SCALE INVERTED;RS-56 (RUSSIAN)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C4H3F5O4
InChI InChI=1S/C4H3F5O4/c5-3(6,4(7,8)9)2(12,13)1(10)11/h12-13H,(H,10,11)
InChIKey JBXUVKGIGNHZQT-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