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ETHYL-(E)-4,4,4-TRIFLUORO-3-(4-METHYLPHENYL)-BUT-2-ENOATE
SpectraBase Compound ID CCsbmtMM2C3
InChI InChI=1S/C13H13F3O2/c1-3-18-12(17)8-11(13(14,15)16)10-6-4-9(2)5-7-10/h4-8H,3H2,1-2H3/b11-8+
InChIKey YXPPNOOGHDVGDM-DHZHZOJOSA-N
Mol Weight 258.24 g/mol
Molecular Formula C13H13F3O2
Exact Mass 258.086764 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Jf5EfTAmAkC
Name ETHYL-(E)-4,4,4-TRIFLUORO-3-(4-METHYLPHENYL)-BUT-2-ENOATE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H13F3O2
InChI InChI=1S/C13H13F3O2/c1-3-18-12(17)8-11(13(14,15)16)10-6-4-9(2)5-7-10/h4-8H,3H2,1-2H3/b11-8+
InChIKey YXPPNOOGHDVGDM-DHZHZOJOSA-N
Literature Reference Author Y.CHEN,L.HUANG,X.P.ZHANG
Literature Reference Citation J.ORG.CHEM.,68,5925(2003)
Literature Reference DOI 10.1021/jo034509z
Molecular Weight 258.240 g/mol
Solvent CDCl3
Source File Reference UWVN20602