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1-[1-(CYANO-2-ETHOXY-2-OXO-ETHYLIDENEAMINOOXY)-DIMETHYLAMINOMORPHOLINOMETHYLENE]-METHANAMINIUM-HEXAFLUOROPHOSPHATE;COMU
SpectraBase Compound ID 4gnPWOQ3pDP
InChI InChI=1S/C12H19N4O4.F6P/c1-4-19-11(17)10(9-13)14-20-12(15(2)3)16-5-7-18-8-6-16;1-7(2,3,4,5)6/h4-8H2,1-3H3;/q+1;-1/b14-10-;
InChIKey GPDHNZNLPKYHCN-DZOOLQPHSA-N
Mol Weight 428.27 g/mol
Molecular Formula C12H19F6N4O4P
Exact Mass 428.104811 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 17TJsoRREbM
Name 1-[1-(CYANO-2-ETHOXY-2-OXO-ETHYLIDENEAMINOOXY)-DIMETHYLAMINOMORPHOLINOMETHYLENE]-METHANAMINIUM-HEXAFLUOROPHOSPHATE;COMU
Compound Number 15B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H19F6N4O4P
InChI InChI=1S/C12H19N4O4.F6P/c1-4-19-11(17)10(9-13)14-20-12(15(2)3)16-5-7-18-8-6-16;1-7(2,3,4,5)6/h4-8H2,1-3H3;/q+1;-1/b14-10-;
InChIKey GPDHNZNLPKYHCN-DZOOLQPHSA-N
Literature Reference Author T.I.AL-WARHI,H.M.A.AL-HAZIMI,A.EL-FAHAM,F.ALBERICIO
Literature Reference Citation MOLECULES,15,9403(2010)
Literature Reference DOI 10.3390/molecules15129403
Molecular Weight 428.271 g/mol
Sample ID 72797
Solvent ACETONE-D6