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pentamethylenebis[dimethyldodecylammonium]dibromide

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pentamethylenebis[dimethyldodecylammonium]dibromide
SpectraBase Compound ID IcZBAF5tmhN
InChI InChI=1S/C33H72N2.2BrH/c1-7-9-11-13-15-17-19-21-23-26-30-34(3,4)32-28-25-29-33-35(5,6)31-27-24-22-20-18-16-14-12-10-8-2;;/h7-33H2,1-6H3;2*1H/q+2;;/p-2
InChIKey WBKKEPDHDRCIOA-UHFFFAOYSA-L
Mol Weight 656.761 g/mol
Molecular Formula C33H72Br2N2
Exact Mass 654.406226 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GmhR2HCOCk2
Name PENTAMETHYLENE-1,5-BIS-(N,N-DIMETHYL-N-DODECYLDODECYL-AMMONIUM-BROMIDE)
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C33H72Br2N2
InChI InChI=1S/C33H72N2.2BrH/c1-7-9-11-13-15-17-19-21-23-26-30-34(3,4)32-28-25-29-33-35(5,6)31-27-24-22-20-18-16-14-12-10-8-2;;/h7-33H2,1-6H3;2*1H/q+2;;/p-2
InChIKey WBKKEPDHDRCIOA-UHFFFAOYSA-L
Literature Reference Author B.BRYCKI,I.KOWALCZYK,A.KOZIROG
Literature Reference Citation MOLECULES,16,319(2011)
Literature Reference DOI 10.3390/molecules16010319
Molecular Weight 656.756 g/mol
Sample ID 72827
Solvent CDCl3