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METHYL-4-[(5-METHYL-3-ISOXAZOL-YL)-AMINO]-6-OXO-7,7,7-TRIFLUORO-4-HEPTENOATE
SpectraBase Compound ID 8gQpWxNvWKA
InChI InChI=1S/C12H13F3N2O4/c1-7-5-10(17-21-7)16-8(3-4-11(19)20-2)6-9(18)12(13,14)15/h5-6H,3-4H2,1-2H3,(H,16,17)/b8-6-
InChIKey WMGPLZWVLCPYFL-VURMDHGXSA-N
Mol Weight 306.24 g/mol
Molecular Formula C12H13F3N2O4
Exact Mass 306.082741 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6WuR7WSGVex
Name METHYL-4-[(5-METHYL-3-ISOXAZOL-YL)-AMINO]-6-OXO-7,7,7-TRIFLUORO-4-HEPTENOATE
Compound Number 3I
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H13F3N2O4
InChI InChI=1S/C12H13F3N2O4/c1-7-5-10(17-21-7)16-8(3-4-11(19)20-2)6-9(18)12(13,14)15/h5-6H,3-4H2,1-2H3,(H,16,17)/b8-6-
InChIKey WMGPLZWVLCPYFL-VURMDHGXSA-N
Literature Reference Author A.F.C.FLORES,D.C.FLORES,G.OLIVEIRA,L.PIZZUTI,R.M.S.D.SILVA,M .A.P.MARTINS
Literature Reference Citation J.BRAZ.CHEM.SOC.,19,184(2008)
Literature Reference DOI 10.1590/s0103-50532008000100026
Molecular Weight 306.241 g/mol
Source File Reference UWIR5136