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Propanoic acid, 2-[(2-chlorobenzoyl)amino]-3,3,3-trifluoro-2-(2-pyridinylamino)-, ethyl ester
SpectraBase Compound ID 4hZjgHbdnv8
InChI InChI=1S/C17H15ClF3N3O3/c1-2-27-15(26)16(17(19,20)21,23-13-9-5-6-10-22-13)24-14(25)11-7-3-4-8-12(11)18/h3-10H,2H2,1H3,(H,22,23)(H,24,25)
InChIKey XIDCOIQJGXVSGM-UHFFFAOYSA-N
Mol Weight 401.77 g/mol
Molecular Formula C17H15ClF3N3O3
Exact Mass 401.075404 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 64vDGbcuw9H
Name Propanoic acid, 2-[(2-chlorobenzoyl)amino]-3,3,3-trifluoro-2-(2-pyridinylamino)-, ethyl ester
Alternate Name(s) 2-[[(2-chlorophenyl)-oxomethyl]amino]-3,3,3-trifluoro-2-(2-pyridinylamino)propanoic acid ethyl ester Ethyl 2-[(2-chlorobenzoyl)amino]-3,3,3-trifluoro-2-(pyridin-2-ylamino)propanoate Ethyl 2-[(2-chlorobenzoyl)amino]-3,3,3-trifluoro-2-(2-pyridylamino)propanoate Ethyl 2-[(2-chlorophenyl)carbonylamino]-3,3,3-tris(fluoranyl)-2-(pyridin-2-ylamino)propanoate
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Formula C17H15ClF3N3O3
InChI InChI=1S/C17H15ClF3N3O3/c1-2-27-15(26)16(17(19,20)21,23-13-9-5-6-10-22-13)24-14(25)11-7-3-4-8-12(11)18/h3-10H,2H2,1H3,(H,22,23)(H,24,25)
InChIKey XIDCOIQJGXVSGM-UHFFFAOYSA-N
Molecular Weight 401.773 g/mol
SMILES N(C(C(OCC)=O)(C(F)(F)F)Nc1ncccc1)C(=O)c1ccccc1Cl
SPLASH splash10-002r-3904000000-0928ac37572ba2252da8
Source of Spectrum IY-2-4908-2
Wiley ID 1657065