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4-(4-BIPHENYL)-1,1,1-TRIFLUORO-4-METHOXYBUT-3-EN-2-ONE
SpectraBase Compound ID DqIo99BWWg2
InChI InChI=1S/C17H13F3O2/c1-22-15(11-16(21)17(18,19)20)14-9-7-13(8-10-14)12-5-3-2-4-6-12/h2-11H,1H3/b15-11-
InChIKey XFBIMKDLEFOYJN-PTNGSMBKSA-N
Mol Weight 306.28 g/mol
Molecular Formula C17H13F3O2
Exact Mass 306.086764 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ByiRhtMHlk0
Name 4-(4-BIPHENYL)-1,1,1-TRIFLUORO-4-METHOXYBUT-3-EN-2-ONE
Compound Number 1I
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H13F3O2
InChI InChI=1S/C17H13F3O2/c1-22-15(11-16(21)17(18,19)20)14-9-7-13(8-10-14)12-5-3-2-4-6-12/h2-11H,1H3/b15-11-
InChIKey XFBIMKDLEFOYJN-PTNGSMBKSA-N
Literature Reference Author H.G.BONACORSO,C.A.CECHINEL,M.R.OLIVIERA,M.B.COSTA,M.A.P.MART INS,N.ZANATTA,A.F.C.
Literature Reference Citation J.HETCYCL.CHEM.,42,1055(2005)
Literature Reference DOI 10.1002/jhet.5570420604
Molecular Weight 306.284 g/mol
Sample ID 61019
Solvent CDCl3