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1-(N,N-DIMETHYLAMMONIO-N-PROPYL-1-SULFONATE)-12-(N'-TRIMETHYLAMMONIUM-IODID)-DODECANE

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1-(N,N-DIMETHYLAMMONIO-N-PROPYL-1-SULFONATE)-12-(N'-TRIMETHYLAMMONIUM-IODID)-DODECANE
SpectraBase Compound ID 61OngjWEJ0e
InChI InChI=1S/C20H45N2O3S.HI/c1-21(2,3)17-14-12-10-8-6-7-9-11-13-15-18-22(4,5)19-16-20-26(23,24)25;/h6-20H2,1-5H3;1H/q+1;/p-1
InChIKey IKYUURJEKJXMDW-UHFFFAOYSA-M
Mol Weight 520.6 g/mol
Molecular Formula C20H45IN2O3S
Exact Mass 520.219559 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5EowOGJW3RX
Name 1-(N,N-DIMETHYLAMMONIO-N-PROPYL-1-SULFONATE)-12-(N'-TRIMETHYLAMMONIUM-IODID)-DODECANE
Compound Number 4B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H45IN2O3S
InChI InChI=1S/C20H45N2O3S.HI/c1-21(2,3)17-14-12-10-8-6-7-9-11-13-15-18-22(4,5)19-16-20-26(23,24)25;/h6-20H2,1-5H3;1H/q+1;/p-1
InChIKey IKYUURJEKJXMDW-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 520.553 g/mol
Solvent D2O