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ETHYL-(2Z)-(2,2,2-TRIFLUORO-1-HYDROXYETHYL)-BUT-2-ENOATE
SpectraBase Compound ID 44YPmvdlSiA
InChI InChI=1S/C8H11F3O3/c1-3-5(7(13)14-4-2)6(12)8(9,10)11/h3,6,12H,4H2,1-2H3/b5-3-
InChIKey YBAVQEDKMGFHOS-HYXAFXHYSA-N
Mol Weight 212.17 g/mol
Molecular Formula C8H11F3O3
Exact Mass 212.066029 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2kKU4D1n0q1
Name ETHYL-(2Z)-(2,2,2-TRIFLUORO-1-HYDROXYETHYL)-BUT-2-ENOATE
Compound Number 6G
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H11F3O3
InChI InChI=1S/C8H11F3O3/c1-3-5(7(13)14-4-2)6(12)8(9,10)11/h3,6,12H,4H2,1-2H3/b5-3-
InChIKey YBAVQEDKMGFHOS-HYXAFXHYSA-N
Literature Reference Author M.K.W.CHOI,H.S.HE,P.H.TOY
Literature Reference Citation J.ORG.CHEM.,68,9831(2003)
Literature Reference DOI 10.1021/jo035226+
Molecular Weight 212.169 g/mol
Solvent CDCl3
Source File Reference UWLU24399