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(E)-5-CYANO-2-(N,N-DIMETHYLIMMONIO)-ETHYLIDENE-4-[(2-ETHOXY-2-OXOETHYL)-AMINO]-6-OXIDO-1,3-OXAZINE
SpectraBase Compound ID 7ZxbSg4BeJ7
InChI InChI=1S/C13H16N4O4/c1-4-20-11(18)8-15-12-9(7-14)13(19)21-10(16-12)5-6-17(2)3/h5-6H,4,8H2,1-3H3,(H,15,19)
InChIKey QHAKKWQYDGOTAC-UHFFFAOYSA-N
Mol Weight 292.29 g/mol
Molecular Formula C13H16N4O4
Exact Mass 292.117155 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KRkqqdsh5fi
Name (E)-5-Cyano-4-[(2-ethoxy-2-oxoethyl)amino]-2-(N.N-dimethylimmonio)ethylidene-6-oxido-1,3-oxazine
Alternate Name(s) (2E)-5-cyano-2-[2-(dimethyliminio)ethylidene]-4-[(2-ethoxy-2-oxoethyl)amino]-2H-1,3-oxazin-6-olate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16N4O4
InChI InChI=1S/C13H16N4O4/c1-4-20-11(18)8-15-12-9(7-14)13(19)21-10(16-12)5-6-17(2)3/h5-6H,4,8H2,1-3H3,(H,15,19)
InChIKey QHAKKWQYDGOTAC-UHFFFAOYSA-N
Molecular Weight 292.295 g/mol
SMILES N(C1=N\C(=C/C=[N+](C)C)OC(=C1C#N)[O-])CC(=O)OCC
SPLASH splash10-0002-9010000000-bcd225bc20ee1e8a6f87
Source of Spectrum H1-51-2901-7
Wiley ID 817455