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ETHYL_2-FLUORO-3-HYDROXY-2-TRIFLUOROMETHYLPENT-4-ENOATE;MIXTURE_OF_STEREOMERS

View entire compound with spectra: 2 NMR

ETHYL_2-FLUORO-3-HYDROXY-2-TRIFLUOROMETHYLPENT-4-ENOATE;MIXTURE_OF_STEREOMERS
SpectraBase Compound ID JjBhGrLTXiJ
InChI InChI=1S/2C8H10F4O3/c2*1-3-5(13)7(9,8(10,11)12)6(14)15-4-2/h2*3,5,13H,1,4H2,2H3/t2*5?,7-/m10/s1
InChIKey VMSLVCOQQZXYRX-MYDGKIHXSA-N
Mol Weight 460.32 g/mol
Molecular Formula C16H20F8O6
Exact Mass 460.113214 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1WMwkrQfz4f
Name ETHYL_2-FLUORO-3-HYDROXY-2-TRIFLUOROMETHYLPENT-4-ENOATE;MIXTURE_OF_STEREOMERS
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H20F8O6
InChI InChI=1S/2C8H10F4O3/c2*1-3-5(13)7(9,8(10,11)12)6(14)15-4-2/h2*3,5,13H,1,4H2,2H3/t2*5?,7-/m10/s1
InChIKey VMSLVCOQQZXYRX-MYDGKIHXSA-N
Literature Reference Author P.L.COE,M.LOEHR,C.ROCHIN
Literature Reference Citation J.CHEM.SOC.PERKIN-1,2803(1998)
Literature Reference DOI 10.1039/a804097d
Molecular Weight 460.318 g/mol
Solvent CDCl3