| SpectraBase Compound ID | CXQJ51W7DWu |
|---|---|
| InChI | InChI=1S/C15H21NO2/c1-12(17)16-8-4-6-14(11-16)9-13-5-3-7-15(10-13)18-2/h3,5,7,10,14H,4,6,8-9,11H2,1-2H3 |
| InChIKey | GXTKGFLWJXTRGE-UHFFFAOYSA-N |
| Mol Weight | 247.34 g/mol |
| Molecular Formula | C15H21NO2 |
| Exact Mass | 247.157229 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6aq8nRWuMFz |
|---|---|
| Name | 1-(3-(3-Methoxybenzyl)piperidin-1-yl)ethan-1-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 247.157228918 u |
| Formula | C15H21NO2 |
| InChI | InChI=1S/C15H21NO2/c1-12(17)16-8-4-6-14(11-16)9-13-5-3-7-15(10-13)18-2/h3,5,7,10,14H,4,6,8-9,11H2,1-2H3 |
| InChIKey | GXTKGFLWJXTRGE-UHFFFAOYSA-N |
| Molecular Weight | 247.338 g/mol |
| SMILES | C1N(CCCC1CC1=CC(=CC=C1)OC)C(C)=O |