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4,4,4-Trifluoro-2-butanone

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4,4,4-Trifluoro-2-butanone
SpectraBase Compound ID I3Rww42qr2N
InChI InChI=1S/C4H5F3O/c1-3(8)2-4(5,6)7/h2H2,1H3
InChIKey BTXXTMOWISPQSJ-UHFFFAOYSA-N
Mol Weight 126.08 g/mol
Molecular Formula C4H5F3O
Exact Mass 126.029249 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5mM5jCc7kRa
Name 4,4,4-Trifluoro-2-butanone
CAS Registry Number 2366-70-3
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C4H5F3O
InChI InChI=1S/C4H5F3O/c1-3(8)2-4(5,6)7/h2H2,1H3
InChIKey BTXXTMOWISPQSJ-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Literature Reference M. Tordeux, J. Leroy, C. Wakselman, Org. Magn. Resonance 14, 407 (1980).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3