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3-(PARA-TOLYL)-2-(TRIFLUOROMETHYL)-CYCLOPENT-2-EN-1-ONE
SpectraBase Compound ID 9WTJScb8GY2
InChI InChI=1S/C13H11F3O/c1-8-2-4-9(5-3-8)10-6-7-11(17)12(10)13(14,15)16/h2-5H,6-7H2,1H3
InChIKey JIFWYUCFSNCEFI-UHFFFAOYSA-N
Mol Weight 240.23 g/mol
Molecular Formula C13H11F3O
Exact Mass 240.076199 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6EVTfcYbcHi
Name 3-(PARA-TOLYL)-2-(TRIFLUOROMETHYL)-CYCLOPENT-2-EN-1-ONE
Compound Number 5A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H11F3O
InChI InChI=1S/C13H11F3O/c1-8-2-4-9(5-3-8)10-6-7-11(17)12(10)13(14,15)16/h2-5H,6-7H2,1H3
InChIKey JIFWYUCFSNCEFI-UHFFFAOYSA-N
Literature Reference Author N.AIGUABELLA,E.M.ARCE,C.D.POZO,X.VERDAGUER,A.RIERA
Literature Reference Citation MOLECULES,19,1763(2014)
Literature Reference DOI 10.3390/molecules19021763
Solvent CDCl3
Source File Reference UWBT14843