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ISOPROPYL-4,4,5,5,5-PENTAFLUORO-3-(4-METHOXYANILINO)-2-PENTENOATE;IMINO-TAUTOMER
SpectraBase Compound ID 4qZ3ocmdJ7X
InChI InChI=1S/C15H16F5NO3/c1-9(2)24-13(22)8-12(14(16,17)15(18,19)20)21-10-4-6-11(23-3)7-5-10/h4-7,9H,8H2,1-3H3/b21-12+
InChIKey ZNQUAWDBGNZUAY-CIAFOILYSA-N
Mol Weight 353.29 g/mol
Molecular Formula C15H16F5NO3
Exact Mass 353.105034 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IMY3MaUn23w
Name ISOPROPYL-4,4,5,5,5-PENTAFLUORO-3-(4-METHOXYANILINO)-2-PENTENOATE;IMINO-TAUTOMER
Compound Number 4E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H16F5NO3
InChI InChI=1S/C15H16F5NO3/c1-9(2)24-13(22)8-12(14(16,17)15(18,19)20)21-10-4-6-11(23-3)7-5-10/h4-7,9H,8H2,1-3H3/b21-12+
InChIKey ZNQUAWDBGNZUAY-CIAFOILYSA-N
Literature Reference Author S.FUSTERO,B.PINA,E.SALAVERT,A.NAVARRO,M.C.R.D.ARELLANO,A.S.F UENTES
Literature Reference Citation J.ORG.CHEM.,67,4667(2002)
Literature Reference DOI 10.1021/jo025621k
Molecular Weight 353.289 g/mol
Solvent CDCl3
Source File Reference UWVN23328