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(E)-METHYL 3-TRIFLUOROMETHYL-4-BENZYLHEX-3-ENOATE
SpectraBase Compound ID 4PXTmkBS2NU
InChI InChI=1S/C15H17F3O2/c1-3-12(9-11-7-5-4-6-8-11)13(15(16,17)18)10-14(19)20-2/h4-8H,3,9-10H2,1-2H3/b13-12+
InChIKey ZWNWHCGLLMQEBA-OUKQBFOZSA-N
Mol Weight 286.29 g/mol
Molecular Formula C15H17F3O2
Exact Mass 286.118064 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KR9BzDhrhgO
Name (E)-METHYL 3-TRIFLUOROMETHYL-4-BENZYLHEX-3-ENOATE
Comments SCALE INVERTED (DIRECT INDICATION IN THE PUBLICATION)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C15H17F3O2
InChI InChI=1S/C15H17F3O2/c1-3-12(9-11-7-5-4-6-8-11)13(15(16,17)18)10-14(19)20-2/h4-8H,3,9-10H2,1-2H3/b13-12+
InChIKey ZWNWHCGLLMQEBA-OUKQBFOZSA-N
Instrument Name Varian EM-360
Literature Reference YANCHANG SHEN, YUEJUN XIANG (1991) J.Fluor.Chem.: v.51, N3, 349-355.
NMR Standard -CF3COOH
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CCl4 carbon tetrachl