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(E)-4-Ethoxy-1,1,1-trifluoro-4-[ethyl(L)leucinate]but-3-en-2-one
SpectraBase Compound ID DRTiPhPpx5F
InChI InChI=1S/C14H22F3NO4/c1-5-21-12(8-11(19)14(15,16)17)18-10(7-9(3)4)13(20)22-6-2/h8-10,18H,5-7H2,1-4H3/b12-8+
InChIKey VXDMVVVBIOFIDG-XYOKQWHBSA-N
Mol Weight 325.33 g/mol
Molecular Formula C14H22F3NO4
Exact Mass 325.150093 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4S0PiakHk2g
Name (E)-4-Ethoxy-1,1,1-trifluoro-4-[ethyl(L)leucinate]but-3-en-2-one
Alternate Name(s) (E)-4-Ethoxy-1,1,1-trifluoro-4-[methyl(L)leucinate]but-3-en-2-one Ethyl 2-{[(1E)-1-ethoxy-4,4,4-trifluoro-3-oxo-1-butenyl]amino}-4-methylpentanoate
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Formula C14H22F3NO4
InChI InChI=1S/C14H22F3NO4/c1-5-21-12(8-11(19)14(15,16)17)18-10(7-9(3)4)13(20)22-6-2/h8-10,18H,5-7H2,1-4H3/b12-8+
InChIKey VXDMVVVBIOFIDG-XYOKQWHBSA-N
Molecular Weight 325.328 g/mol
SMILES N(\C(=C/C(C(F)(F)F)=O)OCC)C(C(=O)OCC)CC(C)C
SPLASH splash10-0udr-7191000000-9648caab0d9b52900648
Source of Spectrum F4-0-1490-2
Wiley ID 1619725