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2-[methoxy-[(4-methoxyphenyl)-methyl-amino]methylene]malonic acid bis(2,2,2-trifluoroethyl) ester
SpectraBase Compound ID LhXO1zH2AFU
InChI InChI=1S/C17H17F6NO6/c1-24(10-4-6-11(27-2)7-5-10)13(28-3)12(14(25)29-8-16(18,19)20)15(26)30-9-17(21,22)23/h4-7H,8-9H2,1-3H3
InChIKey ZTFGSZQOSAIIFN-UHFFFAOYSA-N
Mol Weight 445.31 g/mol
Molecular Formula C17H17F6NO6
Exact Mass 445.096006 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AEZ4UzGNUQQ
Name 2-[methoxy-[(4-methoxyphenyl)-methyl-amino]methylene]malonic acid bis(2,2,2-trifluoroethyl) ester
Compound Number 15A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H17F6NO6
InChI InChI=1S/C17H17F6NO6/c1-24(10-4-6-11(27-2)7-5-10)13(28-3)12(14(25)29-8-16(18,19)20)15(26)30-9-17(21,22)23/h4-7H,8-9H2,1-3H3
InChIKey ZTFGSZQOSAIIFN-UHFFFAOYSA-N
Literature Reference Author Y.X.LEI,Z.RAPPOPORT
Literature Reference Citation J.ORG.CHEM.,67,6971(2002)
Literature Reference DOI 10.1021/jo0203802
Solvent CDCl3
Source File Reference UWMS25053