![benzyl[2-(2,4-dichlorophenoxy)ethyl]dimethylammonium p-toluenesulfonate](/api/spectrum/HZVn1frRRkn/structure.png?h=300&w=458 "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
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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 |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| 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 |