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Methyl 2-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino}-3,3,3-trifluoro-2-propanamidopropanoate
SpectraBase Compound ID 1oxCDOjOBEt
InChI InChI=1S/C13H12ClF6N3O3/c1-3-8(24)22-11(10(25)26-2,13(18,19)20)23-9-7(14)4-6(5-21-9)12(15,16)17/h4-5H,3H2,1-2H3,(H,21,23)(H,22,24)
InChIKey IZGIFVTVKXSQAW-UHFFFAOYSA-N
Mol Weight 407.7 g/mol
Molecular Formula C13H12ClF6N3O3
Exact Mass 407.047138 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5sAwQWzIs0G
Name Methyl 2-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino}-3,3,3-trifluoro-2-propanamidopropanoate
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Formula C13H12ClF6N3O3
InChI InChI=1S/C13H12ClF6N3O3/c1-3-8(24)22-11(10(25)26-2,13(18,19)20)23-9-7(14)4-6(5-21-9)12(15,16)17/h4-5H,3H2,1-2H3,(H,21,23)(H,22,24)
InChIKey IZGIFVTVKXSQAW-UHFFFAOYSA-N
Molecular Weight 407.700 g/mol
SMILES N(C(NC(=O)CC)(C(F)(F)F)C(OC)=O)c1c(cc(cn1)C(F)(F)F)Cl
SPLASH splash10-0a4l-9661000000-17334d6c065786c69bec
Source of Spectrum IY-2-5019-3
Synonyms Propanoic acid, 2-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino]-3,3,3-trifluoro-2-[(1-oxopropyl)amino]-, methyl ester 2-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino]-3,3,3-trifluoro-2-(1-oxopropylamino)propanoic acid methyl ester Methyl 2-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino]-3,3,3-trifluoro-2-(propanoylamino)propanoate Methyl 2-[[3-chloro-5-(trifluoromethyl)-2-pyridyl]amino]-3,3,3-trifluoro-2-(propanoylamino)propanoate Methyl 2-[[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]amino]-3,3,3-tris(fluoranyl)-2-(propanoylamino)propanoate
Wiley ID 1658176