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2-Butenoic acid, 3-methyl-4-oxo-4-[[3-(trifluoromethyl)phenyl]amino]-
SpectraBase Compound ID CbO55aEQwX5
InChI InChI=1S/C12H10F3NO3/c1-7(5-10(17)18)11(19)16-9-4-2-3-8(6-9)12(13,14)15/h2-6H,1H3,(H,16,19)(H,17,18)/b7-5+
InChIKey FBVLUUMNQUGJMJ-FNORWQNLSA-N
Mol Weight 273.21 g/mol
Molecular Formula C12H10F3NO3
Exact Mass 273.061278 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1C1PKZMaivW
Name 2-Butenoic acid, 3-methyl-4-oxo-4-[[3-(trifluoromethyl)phenyl]amino]-
Alternate Name(s) (E)-3-methyl-4-oxo-4-[3-(trifluoromethyl)anilino]-2-butenoic acid (E)-3-methyl-4-oxo-4-[3-(trifluoromethyl)anilino]but-2-enoic acid (E)-3-methyl-4-oxidanylidene-4-[[3-(trifluoromethyl)phenyl]amino]but-2-enoic acid
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Formula C12H10F3NO3
InChI InChI=1S/C12H10F3NO3/c1-7(5-10(17)18)11(19)16-9-4-2-3-8(6-9)12(13,14)15/h2-6H,1H3,(H,16,19)(H,17,18)/b7-5+
InChIKey FBVLUUMNQUGJMJ-FNORWQNLSA-N
Molecular Weight 273.211 g/mol
SMILES N(C(\C(=C\C(=O)O)C)=O)c1cc(C(F)(F)F)ccc1
SPLASH splash10-03di-3900000000-ef41314ee5757efd5ae7
Source of Spectrum IY-1-4362-6
Wiley ID 1651609