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alanine, 3,3,3-trifluoro-N-(2-fluorobenzoyl)-2-(2-pyridinylamino)-,methyl ester
SpectraBase Compound ID EXujcRF8jik
InChI InChI=1S/C16H13F4N3O3/c1-26-14(25)15(16(18,19)20,22-12-8-4-5-9-21-12)23-13(24)10-6-2-3-7-11(10)17/h2-9H,1H3,(H,21,22)(H,23,24)
InChIKey GWSASPQVMVTSFR-UHFFFAOYSA-N
Mol Weight 371.29 g/mol
Molecular Formula C16H13F4N3O3
Exact Mass 371.089304 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3ohuA9920zH
Name 3,3,3-Trifluoro-2-(2-fluoro-benzoylamino)-2-(pyridin-2-ylamino)-propionic acid methyl ester
Alternate Name(s) 3,3,3-trifluoro-2-[(2-fluorobenzoyl)amino]-2-(2-pyridylamino)propionic acid methyl ester 3,3,3-trifluoro-2-[[(2-fluorophenyl)-oxomethyl]amino]-2-(2-pyridinylamino)propanoic acid methyl ester Methyl 3,3,3-trifluoro-2-[(2-fluorobenzoyl)amino]-2-(2-pyridinylamino)propanoate Methyl 3,3,3-trifluoro-2-[(2-fluorobenzoyl)amino]-2-(2-pyridylamino)propanoate Methyl 3,3,3-trifluoro-2-[(2-fluorobenzoyl)amino]-2-(pyridin-2-ylamino)propanoate Methyl 3,3,3-tris(fluoranyl)-2-[(2-fluorophenyl)carbonylamino]-2-(pyridin-2-ylamino)propanoate
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Formula C16H13F4N3O3
InChI InChI=1S/C16H13F4N3O3/c1-26-14(25)15(16(18,19)20,22-12-8-4-5-9-21-12)23-13(24)10-6-2-3-7-11(10)17/h2-9H,1H3,(H,21,22)(H,23,24)
InChIKey GWSASPQVMVTSFR-UHFFFAOYSA-N
Molecular Weight 371.292 g/mol
SMILES N(C(C(F)(F)F)(Nc1ncccc1)C(=O)OC)C(c1c(F)cccc1)=O
SPLASH splash10-00di-6901000000-61d8379c234cc38f178f
Wiley ID 1463322