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1-(N,N-DIMETHYLAMMNIO,N-PROPYL-1-SULFONATE)-16-(N',N'-DIMETHYL,N'-DODECYLAMMNONIUM-BROMIDE)-HEXADECANE
SpectraBase Compound ID C15S10w7w7R
InChI InChI=1S/C35H75N2O3S.BrH/c1-6-7-8-9-10-11-18-21-24-27-31-36(2,3)32-28-25-22-19-16-14-12-13-15-17-20-23-26-29-33-37(4,5)34-30-35-41(38,39)40;/h6-35H2,1-5H3;1H/q+1;/p-1
InChIKey YREJOMKGRMAIST-UHFFFAOYSA-M
Mol Weight 684.0 g/mol
Molecular Formula C35H75BrN2O3S
Exact Mass 682.468178 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Is5kMXnBiBh
Name 1-(N,N-DIMETHYLAMMNIO,N-PROPYL-1-SULFONATE)-16-(N',N'-DIMETHYL,N'-DODECYLAMMNONIUM-BROMIDE)-HEXADECANE
Compound Number 1E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C35H75BrN2O3S
InChI InChI=1S/C35H75N2O3S.BrH/c1-6-7-8-9-10-11-18-21-24-27-31-36(2,3)32-28-25-22-19-16-14-12-13-15-17-20-23-26-29-33-37(4,5)34-30-35-41(38,39)40;/h6-35H2,1-5H3;1H/q+1;/p-1
InChIKey YREJOMKGRMAIST-UHFFFAOYSA-M
Literature Reference Author S.SOUIRTI,M.BABOULENE
Literature Reference Citation CAN.J.CHEM.,81,883(2003)
Literature Reference DOI 10.1139/v03-096
Molecular Weight 683.956 g/mol
Solvent D2O
Source File Reference UWLU30076