![4-{2-[(1-chloro-2-naphthyl)oxy]propionyl}-1-(2-hydroxypropyl)-1-methylpiperazinium bromide](/api/spectrum/LWqnMvX6qwf/structure.png?h=300&w=458 "4-{2-[(1-chloro-2-naphthyl)oxy]propionyl}-1-(2-hydroxypropyl)-1-methylpiperazinium bromide")
| SpectraBase Compound ID | K0sOLh2nz8h |
|---|---|
| InChI | InChI=1S/C21H28ClN2O3.BrH/c1-15(25)14-24(3)12-10-23(11-13-24)21(26)16(2)27-19-9-8-17-6-4-5-7-18(17)20(19)22;/h4-9,15-16,25H,10-14H2,1-3H3;1H/q+1;/p-1 |
| InChIKey | OSNXYLNIXLOFOG-UHFFFAOYSA-M |
| Mol Weight | 471.823 g/mol |
| Molecular Formula | C21H28BrClN2O3 |
| Exact Mass | 470.097183 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LWqnMvX6qwf |
|---|---|
| Name | 4-{2-[(1-chloro-2-naphthyl)oxy]propionyl}-1-(2-hydroxypropyl)-1-methylpiperazinium bromide |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C21H28BrClN2O3 |
| InChI | InChI=1S/C21H28ClN2O3.BrH/c1-15(25)14-24(3)12-10-23(11-13-24)21(26)16(2)27-19-9-8-17-6-4-5-7-18(17)20(19)22;/h4-9,15-16,25H,10-14H2,1-3H3;1H/q+1;/p-1 |
| InChIKey | OSNXYLNIXLOFOG-UHFFFAOYSA-M |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 34970M |
| Solvent | Polysol |