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5-NITRO-6,6,6-TRIFLUOROHEXAN-2-ONE
SpectraBase Compound ID FbT77rE9qOg
InChI InChI=1S/C6H8F3NO3/c1-4(11)2-3-5(10(12)13)6(7,8)9/h5H,2-3H2,1H3
InChIKey NAUVMSFCVSFTNT-UHFFFAOYSA-N
Mol Weight 199.13 g/mol
Molecular Formula C6H8F3NO3
Exact Mass 199.045628 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ANHEFr9QDbE
Name 5-NITRO-6,6,6-TRIFLUOROHEXAN-2-ONE
Comments `+` AXIS-LOW FIELD (DIRECT INDICATION IN THE PUBLICATION).
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C6H8F3NO3
InChI InChI=1S/C6H8F3NO3/c1-4(11)2-3-5(10(12)13)6(7,8)9/h5H,2-3H2,1H3
InChIKey NAUVMSFCVSFTNT-UHFFFAOYSA-N
Instrument Name Bruker WP-80
Literature Reference B.BAASNER, A.MARHOLD, M.NEGELE (1990) J.Fluor.Chem.: v.46, N1, 161-172.
NMR Standard CF3COOH
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3 chloroform-d