| SpectraBase Compound ID | 89YmG5qWc47 |
|---|---|
| InChI | InChI=1S/C22H35NO/c1-3-5-8-14-20-16-22(24)17-21(15-9-6-4-2)23(20)18-19-12-10-7-11-13-19/h7,10-13,20-21H,3-6,8-9,14-18H2,1-2H3 |
| InChIKey | PBWAALAFXDGWRG-UHFFFAOYSA-N |
| Mol Weight | 329.5 g/mol |
| Molecular Formula | C22H35NO |
| Exact Mass | 329.271865 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KVoVJi8P4eU |
|---|---|
| Name | 1-Benzyl-2,6-dipentylpiperidin-4-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 329.271864750 u |
| Formula | C22H35NO |
| InChI | InChI=1S/C22H35NO/c1-3-5-8-14-20-16-22(24)17-21(15-9-6-4-2)23(20)18-19-12-10-7-11-13-19/h7,10-13,20-21H,3-6,8-9,14-18H2,1-2H3 |
| InChIKey | PBWAALAFXDGWRG-UHFFFAOYSA-N |
| Molecular Weight | 329.528 g/mol |
| SMILES | C1(N(C(CC(C1)=O)CCCCC)CC=1C=CC=CC1)CCCCC |