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ETHYL-5-PHENYL-3-(TRIFLUOROMETHYL)-2-PENTENOATE;(E)-ISOMER
SpectraBase Compound ID 7ncsxzwuclI
InChI InChI=1S/C14H15F3O2/c1-2-19-13(18)10-12(14(15,16)17)9-8-11-6-4-3-5-7-11/h3-7,10H,2,8-9H2,1H3/b12-10+
InChIKey BMRLLQBLHJXFFF-ZRDIBKRKSA-N
Mol Weight 272.27 g/mol
Molecular Formula C14H15F3O2
Exact Mass 272.102414 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5XWioCW93xs
Name ETHYL-5-PHENYL-3-(TRIFLUOROMETHYL)-2-PENTENOATE;(E)-ISOMER
Compound Number 4A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H15F3O2
InChI InChI=1S/C14H15F3O2/c1-2-19-13(18)10-12(14(15,16)17)9-8-11-6-4-3-5-7-11/h3-7,10H,2,8-9H2,1H3/b12-10+
InChIKey BMRLLQBLHJXFFF-ZRDIBKRKSA-N
Literature Reference Author M.KIMURA,T.YAMAZAKI,T.KITAZUME,T.KUBOTA
Literature Reference Citation ORG.LETTERS,6,4651(2004)
Literature Reference DOI 10.1021/ol0481941
Solvent CDCl3
Source File Reference UWLU49526