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METHYL-4-METHYL-3-(PENTAFLUOROPHENYL)-5-HEXENOATE
SpectraBase Compound ID JolQmhcG75J
InChI InChI=1S/C14H13F5O2/c1-4-6(2)7(5-8(20)21-3)9-10(15)12(17)14(19)13(18)11(9)16/h4,6-7H,1,5H2,2-3H3
InChIKey LPIFHJMBNLRMGA-UHFFFAOYSA-N
Mol Weight 308.25 g/mol
Molecular Formula C14H13F5O2
Exact Mass 308.08357 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2pJN0CXXgFl
Name METHYL-4-METHYL-3-(PENTAFLUOROPHENYL)-5-HEXENOATE
Compound Number 14B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H13F5O2
InChI InChI=1S/C14H13F5O2/c1-4-6(2)7(5-8(20)21-3)9-10(15)12(17)14(19)13(18)11(9)16/h4,6-7H,1,5H2,2-3H3
InChIKey LPIFHJMBNLRMGA-UHFFFAOYSA-N
Literature Reference Author A.C.ALBENIZ,P.ESPINET,Y.S.LIN
Literature Reference Citation J.AM.CHEM.SOC.,118,7145(1996)
Literature Reference DOI 10.1021/ja960333p
Solvent CDCl3
Source File Reference UWSI36305