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ETHYL (E)-4,4,4-TRIFLUORO-2-METHYL-3-PHENYLBUT-2-ENOATE
SpectraBase Compound ID 4mdWHtnu2SU
InChI InChI=1S/C13H13F3O2/c1-3-18-12(17)9(2)11(13(14,15)16)10-7-5-4-6-8-10/h4-8H,3H2,1-2H3/b11-9+
InChIKey WSCBUKJEKKILPV-PKNBQFBNSA-N
Mol Weight 258.24 g/mol
Molecular Formula C13H13F3O2
Exact Mass 258.086764 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID B8gZk4bQzo8
Name ETHYL (E)-4,4,4-TRIFLUORO-2-METHYL-3-PHENYLBUT-2-ENOATE
Comments SCALE INVERTED (DIRECT INDICATION IN THE PUBLICATION).
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H13F3O2
InChI InChI=1S/C13H13F3O2/c1-3-18-12(17)9(2)11(13(14,15)16)10-7-5-4-6-8-10/h4-8H,3H2,1-2H3/b11-9+
InChIKey WSCBUKJEKKILPV-PKNBQFBNSA-N
Instrument Name Varian EM-360
Literature Reference YANCHANG SHEN, YUEJUN XIANG (1991) J.Fluor.Chem.: v.52, N2, 221-227.
NMR Standard CF3COOH
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CCl4 carbon tetrachl