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(E)-4-[(1R)-(Phenethyl)trifluoroacetamido]-1,1,1-trifluorobutenone
SpectraBase Compound ID 3YuyFNBG3lL
InChI InChI=1S/C14H11F6NO2/c15-13(16,17)8-6-11(22)21(12(23)14(18,19)20)9-7-10-4-2-1-3-5-10/h1-6,8H,7,9H2/b8-6+
InChIKey NEMYYKICQUBNLO-SOFGYWHQSA-N
Mol Weight 339.24 g/mol
Molecular Formula C14H11F6NO2
Exact Mass 339.069398 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L8OhaExWDlT
Name (E)-4-[(1R)-(Phenethyl)trifluoroacetamido]-1,1,1-trifluorobutenone
Alternate Name(s) (E)-4,4,4-trifluoro-N-phenethyl-N-(2,2,2-trifluoroacetyl)but-2-enamide
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Formula C14H11F6NO2
InChI InChI=1S/C14H11F6NO2/c15-13(16,17)8-6-11(22)21(12(23)14(18,19)20)9-7-10-4-2-1-3-5-10/h1-6,8H,7,9H2/b8-6+
InChIKey NEMYYKICQUBNLO-SOFGYWHQSA-N
Molecular Weight 339.237 g/mol
SMILES C(\C=C\C(N(C(C(F)(F)F)=O)CCc1ccccc1)=O)(F)(F)F
SPLASH splash10-0a4u-0946000000-b9b924636584d62d3278
Source of Spectrum F5-4-2797-11
Wiley ID 1732952