![1-[1-(3-Benzoylpropyl)-4-piperidyl]-3-(alpha,alpha,alpha-trifluoro-m-tolyl)urea, monohydrochloride, monohydrate](/api/spectrum/1k7DjgNiIf9/structure.png?h=300&w=458 "1-[1-(3-Benzoylpropyl)-4-piperidyl]-3-(alpha,alpha,alpha-trifluoro-m-tolyl)urea, monohydrochloride, monohydrate")
| SpectraBase Compound ID | DWS1GcHMSoG |
|---|---|
| InChI | InChI=1S/C23H26F3N3O2.ClH.H2O/c24-23(25,26)18-8-4-9-20(16-18)28-22(31)27-19-11-14-29(15-12-19)13-5-10-21(30)17-6-2-1-3-7-17;;/h1-4,6-9,16,19H,5,10-15H2,(H2,27,28,31);1H;1H2 |
| InChIKey | XXWSSSZERBSNOH-UHFFFAOYSA-N |
| Mol Weight | 487.95 g/mol |
| Molecular Formula | C23H29ClF3N3O3 |
| Exact Mass | 487.184954 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1k7DjgNiIf9 |
|---|---|
| Name | 1-[1-(3-benzoylpropyl)-4-piperidyl]-3-(alpha,alpha,alpha-trifluoro-m-tolyl)urea, monohydrochloride, monohydrate |
| Copyright | Copyright © 2009-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C23H29ClF3N3O3 |
| InChI | InChI=1S/C23H26F3N3O2.ClH.H2O/c24-23(25,26)18-8-4-9-20(16-18)28-22(31)27-19-11-14-29(15-12-19)13-5-10-21(30)17-6-2-1-3-7-17;;/h1-4,6-9,16,19H,5,10-15H2,(H2,27,28,31);1H;1H2 |
| InChIKey | XXWSSSZERBSNOH-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 36657M |
| Solvent | Polysol |