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2-METHOXY-2-TRIFLUOROMETHYL-3-OXO-1,4-DIOXANE
SpectraBase Compound ID HIMJv1mRcK7
InChI InChI=1S/C6H7F3O4/c1-11-5(6(7,8)9)4(10)12-2-3-13-5/h2-3H2,1H3
InChIKey AKGAIOAHFLEYIX-UHFFFAOYSA-N
Mol Weight 200.11 g/mol
Molecular Formula C6H7F3O4
Exact Mass 200.029643 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9X2rsuMmBS0
Name 2-METHOXY-2-TRIFLUOROMETHYL-3-OXO-1,4-DIOXANE
Comments SCALE INVERTED (DIRECT INDICATION IN THE PUBLICATION).
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C6H7F3O4
InChI InChI=1S/C6H7F3O4/c1-11-5(6(7,8)9)4(10)12-2-3-13-5/h2-3H2,1H3
InChIKey AKGAIOAHFLEYIX-UHFFFAOYSA-N
Instrument Name Varian XL-100
Literature Reference MARK J. PELLERITE (1990) J.Fluor.Chem.: v.49, N1, 43-66.
NMR Standard CCl3F
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent not reported