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Propanoic acid, 2-(benzoylamino)-3,3,3-trifluoro-2-[[4-(trifluoromethoxy)phenyl]amino]-, ethyl ester
SpectraBase Compound ID JFv3wURAfr7
InChI InChI=1S/C19H16F6N2O4/c1-2-30-16(29)17(18(20,21)22,27-15(28)12-6-4-3-5-7-12)26-13-8-10-14(11-9-13)31-19(23,24)25/h3-11,26H,2H2,1H3,(H,27,28)
InChIKey MBDUISGPCXSUOV-UHFFFAOYSA-N
Mol Weight 450.34 g/mol
Molecular Formula C19H16F6N2O4
Exact Mass 450.101426 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A0ZBKfwXPgg
Name Propanoic acid, 2-(benzoylamino)-3,3,3-trifluoro-2-[[4-(trifluoromethoxy)phenyl]amino]-, ethyl ester
Alternate Name(s) 2-Benzamido-3,3,3-trifluoro-2-[4-(trifluoromethoxy)anilino]propanoic acid ethyl ester Ethyl 2-benzamido-3,3,3-trifluoro-2-[4-(trifluoromethoxy)anilino]propanoate Ethyl 2-benzamido-3,3,3-tris(fluoranyl)-2-[[4-(trifluoromethyloxy)phenyl]amino]propanoate
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Formula C19H16F6N2O4
InChI InChI=1S/C19H16F6N2O4/c1-2-30-16(29)17(18(20,21)22,27-15(28)12-6-4-3-5-7-12)26-13-8-10-14(11-9-13)31-19(23,24)25/h3-11,26H,2H2,1H3,(H,27,28)
InChIKey MBDUISGPCXSUOV-UHFFFAOYSA-N
Molecular Weight 450.337 g/mol
SMILES N(C(C(OCC)=O)(C(F)(F)F)Nc1ccc(cc1)OC(F)(F)F)C(=O)c1ccccc1
SPLASH splash10-0a4i-4911000000-b18726938e2047823c4e
Source of Spectrum IY-2-4886-8
Wiley ID 1656625