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2,6-Bis(4,4,4-trifluoro-1-methyl-3-oxobut-1-enylamino)hexanoic acid
SpectraBase Compound ID E0FmhfHLAJm
InChI InChI=1S/C16H20F6N2O4/c1-9(7-12(25)15(17,18)19)23-6-4-3-5-11(14(27)28)24-10(2)8-13(26)16(20,21)22/h7-8,11,23-24H,3-6H2,1-2H3,(H,27,28)/b9-7+,10-8+
InChIKey CUVSQDHOJYCSNO-FIFLTTCUSA-N
Mol Weight 418.34 g/mol
Molecular Formula C16H20F6N2O4
Exact Mass 418.132726 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5kJ3CLnEzEW
Name 2,6-Bis(4,4,4-trifluoro-1-methyl-3-oxobut-1-enylamino)hexanoic acid
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Formula C16H20F6N2O4
InChI InChI=1S/C16H20F6N2O4/c1-9(7-12(25)15(17,18)19)23-6-4-3-5-11(14(27)28)24-10(2)8-13(26)16(20,21)22/h7-8,11,23-24H,3-6H2,1-2H3,(H,27,28)/b9-7+,10-8+
InChIKey CUVSQDHOJYCSNO-FIFLTTCUSA-N
Molecular Weight 418.336 g/mol
SMILES N(\C(=C\C(C(F)(F)F)=O)C)CCCCC(C(=O)O)N\C(=C\C(C(F)(F)F)=O)C
SPLASH splash10-00di-0291100000-8ac0dee2ebab696d689f
Source of Spectrum CV-2002-2415-8
Synonyms N(2),N(6)-bis[(1E)-4,4,4-trifluoro-1-methyl-3-oxo-1-butenyl]lysine
Wiley ID 1610390