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benzyl[2-(2,4-dichlorophenoxy)ethyl]dimethylammonium p-toluenesulfonate
SpectraBase Compound ID EWcdSZTPlTT
InChI InChI=1S/C17H20Cl2NO.C7H8O3S/c1-20(2,13-14-6-4-3-5-7-14)10-11-21-17-9-8-15(18)12-16(17)19;1-6-2-4-7(5-3-6)11(8,9)10/h3-9,12H,10-11,13H2,1-2H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1
InChIKey RLSJICPCQNUFHQ-UHFFFAOYSA-M
Mol Weight 496.45 g/mol
Molecular Formula C24H27Cl2NO4S
Exact Mass 495.103785 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HZVn1frRRkn
Name benzyl[2-(2,4-dichlorophenoxy)ethyl]dimethylammonium p-toluenesulfonate
Source of Sample Martsinovskii Institute of Medicine, Moscow, Russia
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Formula C24H27Cl2NO4S
InChI InChI=1S/C17H20Cl2NO.C7H8O3S/c1-20(2,13-14-6-4-3-5-7-14)10-11-21-17-9-8-15(18)12-16(17)19;1-6-2-4-7(5-3-6)11(8,9)10/h3-9,12H,10-11,13H2,1-2H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1
InChIKey RLSJICPCQNUFHQ-UHFFFAOYSA-M
Instrument Name Varian A-60
Sadtler NMR Number 3123M
Solvent CDCl3