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1-(N,N-DIMETHYLAMMONIO-N-PROPYL-1-SULFONATE)-8-(N',N'-DIMETHYL-N'-ETHYLACETATE-AMMONIUM-BROMID)-OCTANE

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1-(N,N-DIMETHYLAMMONIO-N-PROPYL-1-SULFONATE)-8-(N',N'-DIMETHYL-N'-ETHYLACETATE-AMMONIUM-BROMID)-OCTANE
SpectraBase Compound ID BJt4rnjrbel
InChI InChI=1S/C18H39N2O5S.BrH/c1-19(2,15-12-16-26(22,23)24)13-10-8-6-7-9-11-14-20(3,4)17-18(21)25-5;/h6-17H2,1-5H3;1H/q+1;/p-1
InChIKey DOMJCONQLIRZIM-UHFFFAOYSA-M
Mol Weight 475.5 g/mol
Molecular Formula C18H39BrN2O5S
Exact Mass 474.176307 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 65KlU0qFZk9
Name 1-(N,N-DIMETHYLAMMONIO-N-PROPYL-1-SULFONATE)-8-(N',N'-DIMETHYL-N'-ETHYLACETATE-AMMONIUM-BROMID)-OCTANE
Compound Number 5A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H39BrN2O5S
InChI InChI=1S/C18H39N2O5S.BrH/c1-19(2,15-12-16-26(22,23)24)13-10-8-6-7-9-11-14-20(3,4)17-18(21)25-5;/h6-17H2,1-5H3;1H/q+1;/p-1
InChIKey DOMJCONQLIRZIM-UHFFFAOYSA-M
Literature Reference Author S.SOUIRTI,M.BABOULENE
Literature Reference Citation CAN.J.CHEM.,79,1153(2001)
Literature Reference DOI 10.1139/cjc-79-7-1153
Molecular Weight 475.482 g/mol
Solvent D2O