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N-CYANOMETHYL-N-[(E)-1-CYANOBUT-2-ENYL]-N,N-DIMETHYLAMMONIUM_PERCHLORATE
SpectraBase Compound ID 4HKhh2vIoul
InChI InChI=1S/C9H14N3.ClHO4/c1-4-5-9(8-11)12(2,3)7-6-10;2-1(3,4)5/h4-5,9H,7H2,1-3H3;(H,2,3,4,5)/q+1;/p-1/b5-4+;
InChIKey SAAJMNNNNHAMFI-FXRZFVDSSA-M
Mol Weight 263.68 g/mol
Molecular Formula C9H14ClN3O4
Exact Mass 263.067284 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DgydeoJFzr0
Name N-CYANOMETHYL-N-[(E)-1-CYANOBUT-2-ENYL]-N,N-DIMETHYLAMMONIUM_PERCHLORATE
Compound Number 3B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H14ClN3O4
InChI InChI=1S/C9H14N3.ClHO4/c1-4-5-9(8-11)12(2,3)7-6-10;2-1(3,4)5/h4-5,9H,7H2,1-3H3;(H,2,3,4,5)/q+1;/p-1/b5-4+;
InChIKey SAAJMNNNNHAMFI-FXRZFVDSSA-M
Literature Reference Author A.JONCZYK,T.ZDROJEWSKI,P.GRZYWACZ,P.BALCERZAK
Literature Reference Citation J.CHEM.SOC.PERKIN-1,2919(1996)
Literature Reference DOI 10.1039/p19960002919
Molecular Weight 263.681 g/mol
Solvent DMSO-D6
Source File Reference UWMZ3150