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2-METHYLENE-3-HYDROXY-3-TRIFLUOROMETHYL-4,4-DIFLUORO-4-BROMOBUTANOICACID, ETHYL ESTER
SpectraBase Compound ID Ddl628JuNf6
InChI InChI=1S/C8H8BrF5O3/c1-3-17-5(15)4(2)6(16,7(9,10)11)8(12,13)14/h16H,2-3H2,1H3
InChIKey ALINOMWFBUTHES-UHFFFAOYSA-N
Mol Weight 327.05 g/mol
Molecular Formula C8H8BrF5O3
Exact Mass 325.957698 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 11T30VHvAPD
Name 2-METHYLENE-3-HYDROXY-3-TRIFLUOROMETHYL-4,4-DIFLUORO-4-BROMOBUTANOICACID, ETHYL ESTER
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 C8H8BrF5O3
InChI InChI=1S/C8H8BrF5O3/c1-3-17-5(15)4(2)6(16,7(9,10)11)8(12,13)14/h16H,2-3H2,1H3
InChIKey ALINOMWFBUTHES-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