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1-(2-CYANOETHYL)-3-(2-METHOXY-2-OXOETHYL)-1H-IMIDAZOL-3-IUM-BROMIDE
SpectraBase Compound ID 6ed5bN3o8Ln
InChI InChI=1S/C9H12N3O2.BrH/c1-14-9(13)7-12-6-5-11(8-12)4-2-3-10;/h5-6,8H,2,4,7H2,1H3;1H/q+1;/p-1
InChIKey RDLODTCVLNGWMC-UHFFFAOYSA-M
Mol Weight 274.12 g/mol
Molecular Formula C9H12BrN3O2
Exact Mass 273.01129 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6EbLFVYOD9C
Name 1-(2-CYANOETHYL)-3-(2-METHOXY-2-OXOETHYL)-1H-IMIDAZOL-3-IUM-BROMIDE
Compound Number 3B
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Formula C9H12BrN3O2
InChI InChI=1S/C9H12N3O2.BrH/c1-14-9(13)7-12-6-5-11(8-12)4-2-3-10;/h5-6,8H,2,4,7H2,1H3;1H/q+1;/p-1
InChIKey RDLODTCVLNGWMC-UHFFFAOYSA-M
Literature Reference Author G.ZBANCIOC,V.BEJAN,M.RISCA,C.MOLDOVEANU,I.I.MANGALAGIU
Literature Reference Citation MOLECULES,14,403(2009)
Literature Reference DOI 10.3390/molecules14010403
Molecular Weight 274.117 g/mol
Sample ID 69081
Solvent CDCl3