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[(methylimido)diethylene]bis[dimethyl(2-hydroxyethyl)ammonium] dibromide, dihexanoate (ester)

View entire compound with spectra: 2 NMR, and 1 FTIR

[(methylimido)diethylene]bis[dimethyl(2-hydroxyethyl)ammonium] dibromide, dihexanoate (ester)
SpectraBase Compound ID 4xJuQBk3voE
InChI InChI=1S/C25H53N3O4.2BrH/c1-8-10-12-14-24(29)31-22-20-27(4,5)18-16-26(3)17-19-28(6,7)21-23-32-25(30)15-13-11-9-2;;/h8-23H2,1-7H3;2*1H/q+2;;/p-2
InChIKey COAHQHMHOHVKHZ-UHFFFAOYSA-L
Mol Weight 619.524 g/mol
Molecular Formula C25H53Br2N3O4
Exact Mass 617.240283 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 88DOR226OjZ
Name [(METHYLIMINO)DIETHYLENE]BIS[DIMETHYL(2-HYDROXYETHYL)AMMONIUM] DIBROMIDE, DIHEXANOATE (ESTER)
Source of Sample F. Devinsky, Komensky University, Bratislava, Czechoslovakia
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H53Br2N3O4
InChI InChI=1S/C25H53N3O4.2BrH/c1-8-10-12-14-24(29)31-22-20-27(4,5)18-16-26(3)17-19-28(6,7)21-23-32-25(30)15-13-11-9-2;;/h8-23H2,1-7H3;2*1H/q+2;;/p-2
InChIKey COAHQHMHOHVKHZ-UHFFFAOYSA-L
Melting Point 191-192C
Molecular Weight 619.54
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20