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[(methylimino)diethylene]bis[dimethyl(2-hydroxyethyl)ammonium] dibromide, dioctanoate (ester)
SpectraBase Compound ID 6v69vM2pu1b
InChI InChI=1S/C29H61N3O4.2BrH/c1-8-10-12-14-16-18-28(33)35-26-24-31(4,5)22-20-30(3)21-23-32(6,7)25-27-36-29(34)19-17-15-13-11-9-2;;/h8-27H2,1-7H3;2*1H/q+2;;/p-2
InChIKey RVJGCTPNEBZDTE-UHFFFAOYSA-L
Mol Weight 675.632 g/mol
Molecular Formula C29H61Br2N3O4
Exact Mass 673.302883 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IOsKkLY9St7
Name [(METHYLIMINO)DIETHYLENE]BIS[DIMETHYL(2-HYDROXYETHYL)AMMONIUM] DIBROMIDE, DIOCTANOATE (ESTER)
Source of Sample F. Devinsky, Komensky University, Bratislava, Czechoslovakia
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H61Br2N3O4
InChI InChI=1S/C29H61N3O4.2BrH/c1-8-10-12-14-16-18-28(33)35-26-24-31(4,5)22-20-30(3)21-23-32(6,7)25-27-36-29(34)19-17-15-13-11-9-2;;/h8-27H2,1-7H3;2*1H/q+2;;/p-2
InChIKey RVJGCTPNEBZDTE-UHFFFAOYSA-L
Melting Point 204-206C
Molecular Weight 675.65
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20