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(E)-5-CYANO-2-(N,N-DIMETHYLIMMONIO)-ETHYLIDENE-4-[[2-ETHOXY-1-(PARA-HYDROXYPHENYL)-2-OXOETHYL]-AMINO]-6-OXIDO-1,3-OXAZINE

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(E)-5-CYANO-2-(N,N-DIMETHYLIMMONIO)-ETHYLIDENE-4-[[2-ETHOXY-1-(PARA-HYDROXYPHENYL)-2-OXOETHYL]-AMINO]-6-OXIDO-1,3-OXAZINE
SpectraBase Compound ID 94j5OlsPfeV
InChI InChI=1S/C20H22N4O5/c1-4-28-20(27)16(11-13-5-7-14(25)8-6-13)22-18-15(12-21)19(26)29-17(23-18)9-10-24(2)3/h5-10,16H,4,11H2,1-3H3,(H2,22,25,26)
InChIKey VIPPSYZNCUTREY-UHFFFAOYSA-N
Mol Weight 398.42 g/mol
Molecular Formula C20H22N4O5
Exact Mass 398.15902 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KzxO6dbScg0
Name (E)-5-CYANO-2-(N,N-DIMETHYLIMMONIO)-ETHYLIDENE-4-[[2-ETHOXY-1-(PARA-HYDROXYPHENYL)-2-OXOETHYL]-AMINO]-6-OXIDO-1,3-OXAZINE
Compound Number 7C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H22N4O5
InChI InChI=1S/C20H22N4O5/c1-4-28-20(27)16(11-13-5-7-14(25)8-6-13)22-18-15(12-21)19(26)29-17(23-18)9-10-24(2)3/h5-10,16H,4,11H2,1-3H3,(H2,22,25,26)
InChIKey VIPPSYZNCUTREY-UHFFFAOYSA-N
Literature Reference Author Z.WANG,W.KRAMER,R.NEIDLEIN
Literature Reference Citation HETEROCYCLES,51,2893(1999)
Literature Reference DOI 10.3987/COM-99-8696
Molecular Weight 398.418 g/mol
Solvent DMSO-D6