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3-METHYL-4-PENTAFLUOROPHENYL-3-BUTEN-2-ONE
SpectraBase Compound ID Bi84qhhmwCh
InChI InChI=1S/C11H7F5O/c1-4(5(2)17)3-6-7(12)9(14)11(16)10(15)8(6)13/h3H,1-2H3/b4-3+
InChIKey JXYMVZQZDLOQBH-ONEGZZNKSA-N
Mol Weight 250.17 g/mol
Molecular Formula C11H7F5O
Exact Mass 250.041706 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HvibPxw9CkV
Name 3-METHYL-4-PENTAFLUOROPHENYL-3-BUTEN-2-ONE
Comments ALL PEAKS WERE ASSIGNED (S.T.)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C11H7F5O
InChI InChI=1S/C11H7F5O/c1-4(5(2)17)3-6-7(12)9(14)11(16)10(15)8(6)13/h3H,1-2H3/b4-3+
InChIKey JXYMVZQZDLOQBH-ONEGZZNKSA-N
Instrument Name Varian A56/60A
Literature Reference T.V.MIKHALINA, E.P.FOKIN (1986) Izv.Sibir.Otdel.Akad.Nauk Ser.Khim.(Russ.Lang.): N5, 119-122.
NMR Standard C6F6
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent C4H8O tetrahydrofura