2-cyano-3-keto-3-[(4-methylphenyl)amino]propionic acid 2,2,2-trifluoroethyl ester

SpectraBase Compound ID	1kaNJ28MU7L
InChI	InChI=1S/C13H11F3N2O3/c1-8-2-4-9(5-3-8)18-11(19)10(6-17)12(20)21-7-13(14,15)16/h2-5,10H,7H2,1H3,(H,18,19)
InChIKey	OJWKWNJHBTWAQQ-UHFFFAOYSA-N Google Search
Mol Weight	300.24 g/mol
Molecular Formula	C13H11F3N2O3
Exact Mass	300.072177 g/mol

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SpectraBase Spectrum ID	Et9Ihodxo7f
Name	2-cyano-3-keto-3-[(4-methylphenyl)amino]propionic acid 2,2,2-trifluoroethyl ester
Compound Number	6B
Copyright	Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula	C13H11F3N2O3
InChI	InChI=1S/C13H11F3N2O3/c1-8-2-4-9(5-3-8)18-11(19)10(6-17)12(20)21-7-13(14,15)16/h2-5,10H,7H2,1H3,(H,18,19)
InChIKey	OJWKWNJHBTWAQQ-UHFFFAOYSA-N
Literature Reference Author	Y.X.LEI,D.CASARINI,G.CERIONI,Z.RAPPOPORT
Literature Reference Citation	J.ORG.CHEM.,68,947(2003)
Literature Reference DOI	10.1021/jo020464a
Solvent	THF-D8
Source File Reference	UWLU22786