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TRANS-4-ACETOXY-5,5,5-TRIFLUORO-3-PENTEN-2-ONE
SpectraBase Compound ID IZN33m6MSAH
InChI InChI=1S/C7H7F3O3/c1-4(11)3-6(7(8,9)10)13-5(2)12/h3H,1-2H3/b6-3+
InChIKey WLAFIDPOPODXTH-ZZXKWVIFSA-N
Mol Weight 196.13 g/mol
Molecular Formula C7H7F3O3
Exact Mass 196.034729 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7fV0zX70fEy
Name TRANS-4-ACETOXY-5,5,5-TRIFLUORO-3-PENTEN-2-ONE
Comments ISOMER 2. SCALE INVERTED
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C7H7F3O3
InChI InChI=1S/C7H7F3O3/c1-4(11)3-6(7(8,9)10)13-5(2)12/h3H,1-2H3/b6-3+
InChIKey WLAFIDPOPODXTH-ZZXKWVIFSA-N
Instrument Name Tesla BS487
Literature Reference V.I.MINKIN, L.P.OLEKHNOVICH, YU.A.ZHDANOV, V.V.KISELEV, V.P.METLUSHENKO,N.I.BORISENKO (1974) Zhurn.Org.Khim.(Russ. Lang.): v.10, N11, 2248-2256.
NMR Standard CCl3F
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent C6H4NO2F para-fluoro