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2-HYDROXY-2-TRIFLUOROMETHYL-3-METHYLIDENE-4-OXOPENTANOIC ACID, METHYLESTER
SpectraBase Compound ID 6ExyH6psePM
InChI InChI=1S/C8H9F3O4/c1-4(5(2)12)7(14,6(13)15-3)8(9,10)11/h14H,1H2,2-3H3
InChIKey AHOZSCUDUCKHJL-UHFFFAOYSA-N
Mol Weight 226.15 g/mol
Molecular Formula C8H9F3O4
Exact Mass 226.045293 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2r50c3SUael
Name 2-HYDROXY-2-TRIFLUOROMETHYL-3-METHYLIDENE-4-OXOPENTANOIC ACID, METHYLESTER
Comments MAY BE AC-200 (BRUKER). SCALE INVERTED.;WP-200SY (BRUKER)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C8H9F3O4
InChI InChI=1S/C8H9F3O4/c1-4(5(2)12)7(14,6(13)15-3)8(9,10)11/h14H,1H2,2-3H3
InChIKey AHOZSCUDUCKHJL-UHFFFAOYSA-N
Instrument Name SEE COMMENT
Literature Reference A.S.GOLUBEV, M.V.GALAKHOV, A.F.KOLOMIETS, A.V.FOKIN (1992) Izv.Akad.NaukSSSR(Russ. Lang.): N12, 2763-2767.
NMR Standard -CF3COOH
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent C3D6O acetone-d6