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4,4-DIFLUORO-1-(2-METHOXYPHENYL)-3-(TRIFLUOROMETHYL)-BUT-3-EN-1-ONE

View entire compound with spectra: 2 NMR, and 1 MS (GC)

4,4-DIFLUORO-1-(2-METHOXYPHENYL)-3-(TRIFLUOROMETHYL)-BUT-3-EN-1-ONE
SpectraBase Compound ID 4kFnBLFdW4A
InChI InChI=1S/C12H9F5O2/c1-19-10-5-3-2-4-7(10)9(18)6-8(11(13)14)12(15,16)17/h2-5H,6H2,1H3
InChIKey UPULAWBPGSCSBP-UHFFFAOYSA-N
Mol Weight 280.19 g/mol
Molecular Formula C12H9F5O2
Exact Mass 280.05227 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KnjCLldtFlR
Name 4,4-DIFLUORO-1-(2-METHOXYPHENYL)-3-(TRIFLUOROMETHYL)-BUT-3-EN-1-ONE
Compound Number 6C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H9F5O2
InChI InChI=1S/C12H9F5O2/c1-19-10-5-3-2-4-7(10)9(18)6-8(11(13)14)12(15,16)17/h2-5H,6H2,1H3
InChIKey UPULAWBPGSCSBP-UHFFFAOYSA-N
Literature Reference Author K.BURGER,B.HELMREICH,L.HENNIG,J.SPENGLER,F.ALBERICIO,A.FUCHS
Literature Reference Citation MH.CHEM.,138,227(2007)
Literature Reference DOI 10.1007/s00706-007-0587-4
Solvent CDCl3
Source File Reference UWLU68546