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(E)-5,5-difluoro-4-keto-2-methyl-3-phenyl-pent-2-enal
SpectraBase Compound ID IwZIdPk3G2r
InChI InChI=1S/C12H10F2O2/c1-8(7-15)10(11(16)12(13)14)9-5-3-2-4-6-9/h2-7,12H,1H3/b10-8+
InChIKey YXPJXAVFRGRNTI-CSKARUKUSA-N
Mol Weight 224.21 g/mol
Molecular Formula C12H10F2O2
Exact Mass 224.064886 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Kmz4KMjQdcR
Name (E)-5,5-difluoro-4-keto-2-methyl-3-phenyl-pent-2-enal
Compound Number 9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H10F2O2
InChI InChI=1S/C12H10F2O2/c1-8(7-15)10(11(16)12(13)14)9-5-3-2-4-6-9/h2-7,12H,1H3/b10-8+
InChIKey YXPJXAVFRGRNTI-CSKARUKUSA-N
Literature Reference Author P.E.HARRINGTON,L.LI,M.A.TIUS
Literature Reference Citation J.ORG.CHEM.,64,4025(1999)
Literature Reference DOI 10.1021/jo9900477
Molecular Weight 224.207 g/mol
Sample ID 39794
Solvent CDCl3