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Ethyl 2-(5-phenylhex-4-enyl)trifluoroacetylacetate

View entire compound with spectra: 2 NMR

Ethyl 2-(5-phenylhex-4-enyl)trifluoroacetylacetate
SpectraBase Compound ID LHiMweaZjUt
InChI InChI=1S/C18H21F3O3/c1-3-24-17(23)15(16(22)18(19,20)21)12-8-7-9-13(2)14-10-5-4-6-11-14/h4-6,9-11,15H,3,7-8,12H2,1-2H3/b13-9-
InChIKey NPYNYHNSDSQGRB-LCYFTJDESA-N
Mol Weight 342.36 g/mol
Molecular Formula C18H21F3O3
Exact Mass 342.144279 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9yB9ah0sd2T
Name Ethyl 2-(5-phenylhex-4-enyl)trifluoroacetylacetate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 342.144279022 u
Formula C18H21F3O3
InChI InChI=1S/C18H21F3O3/c1-3-24-17(23)15(16(22)18(19,20)21)12-8-7-9-13(2)14-10-5-4-6-11-14/h4-6,9-11,15H,3,7-8,12H2,1-2H3/b13-9-
InChIKey NPYNYHNSDSQGRB-LCYFTJDESA-N
Molecular Weight 342.358 g/mol
SMILES C(=O)(C(F)(F)F)C(C(=O)OCC)CCC\C=C\(C)c1ccccc1