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2-[(4-chlorobenzoyl)amino]-2-[(3,5-dichloro-2-pyridyl)amino]-3,3,3-trifluoro-propionic acid methyl ester
SpectraBase Compound ID 8tZr1XJ6ZbC
InChI InChI=1S/C16H11Cl3F3N3O3/c1-28-14(27)15(16(20,21)22,24-12-11(19)6-10(18)7-23-12)25-13(26)8-2-4-9(17)5-3-8/h2-7H,1H3,(H,23,24)(H,25,26)
InChIKey SCNOMIQGBPXJLC-UHFFFAOYSA-N
Mol Weight 456.64 g/mol
Molecular Formula C16H11Cl3F3N3O3
Exact Mass 454.981809 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9Pe2X2gwbl1
Name 2-[(4-chlorobenzoyl)amino]-2-[(3,5-dichloro-2-pyridyl)amino]-3,3,3-trifluoro-propionic acid methyl ester
Alternate Name(s) 2-[[(4-chlorophenyl)-oxomethyl]amino]-2-[(3,5-dichloro-2-pyridinyl)amino]-3,3,3-trifluoropropanoic acid methyl ester Methyl 2-[(4-chlorobenzoyl)amino]-2-[(3,5-dichloro-2-pyridyl)amino]-3,3,3-trifluoro-propanoate Methyl 2-[(4-chlorobenzoyl)amino]-2-[(3,5-dichloropyridin-2-yl)amino]-3,3,3-trifluoropropanoate Methyl 2-[[3,5-bis(chloranyl)pyridin-2-yl]amino]-2-[(4-chlorophenyl)carbonylamino]-3,3,3-tris(fluoranyl)propanoate
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Formula C16H11Cl3F3N3O3
InChI InChI=1S/C16H11Cl3F3N3O3/c1-28-14(27)15(16(20,21)22,24-12-11(19)6-10(18)7-23-12)25-13(26)8-2-4-9(17)5-3-8/h2-7H,1H3,(H,23,24)(H,25,26)
InChIKey SCNOMIQGBPXJLC-UHFFFAOYSA-N
Molecular Weight 456.636 g/mol
SMILES N(C(Nc1ncc(cc1Cl)Cl)(C(F)(F)F)C(=O)OC)C(c1ccc(cc1)Cl)=O
SPLASH splash10-000b-1906300000-10623d0ff155d189f4b4
Wiley ID 1462808