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(thiodiethylene)bis[dimethyloctadecylammonium]dibromide

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

(thiodiethylene)bis[dimethyloctadecylammonium]dibromide
SpectraBase Compound ID DbiBOdWwGQ5
InChI InChI=1S/C44H94N2S.2BrH/c1-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-45(3,4)41-43-47-44-42-46(5,6)40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-2;;/h7-44H2,1-6H3;2*1H/q+2;;/p-2
InChIKey WQRVGACCEWCSSZ-UHFFFAOYSA-L
Mol Weight 843.118 g/mol
Molecular Formula C44H94Br2N2S
Exact Mass 840.550448 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6fEe8X7nEI0
Name (THIODIETHYLENE)BIS[DIMETHYLOCTADECYLAMMONIUM] DIBROMIDE
Source of Sample F. Devinsky, Komensky University, Bratislava, Czechoslovakia
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C44H94Br2N2S
InChI InChI=1S/C44H94N2S.2BrH/c1-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-45(3,4)41-43-47-44-42-46(5,6)40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-2;;/h7-44H2,1-6H3;2*1H/q+2;;/p-2
InChIKey WQRVGACCEWCSSZ-UHFFFAOYSA-L
Melting Point 207-209C
Molecular Weight 843.14
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Synonyms AMMONIUM DIBROMIDE, /THIODIETHYLENE/BIS/DIMETHYLOCTADECYL-,