| SpectraBase Compound ID | KO6DMerPB1Q |
|---|---|
| InChI | InChI=1S/C18H27NO2/c1-3-7-15(2)18(20)21-17-10-12-19(13-11-17)14-16-8-5-4-6-9-16/h4-6,8-9,15,17H,3,7,10-14H2,1-2H3 |
| InChIKey | JMZMUWWGMRJKTA-UHFFFAOYSA-N |
| Mol Weight | 289.42 g/mol |
| Molecular Formula | C18H27NO2 |
| Exact Mass | 289.204179 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Fr1qjnpGyDv |
|---|---|
| Name | 1-Benzylpiperidin-4-yl-2-methyl pentanoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 289.204179111 u |
| Formula | C18H27NO2 |
| InChI | InChI=1S/C18H27NO2/c1-3-7-15(2)18(20)21-17-10-12-19(13-11-17)14-16-8-5-4-6-9-16/h4-6,8-9,15,17H,3,7,10-14H2,1-2H3 |
| InChIKey | JMZMUWWGMRJKTA-UHFFFAOYSA-N |
| SMILES | C(N1CCC(OC(C(CCC)C)=O)CC1)C=1C=CC=CC1 |