| SpectraBase Compound ID | KNR7iBepUJB |
|---|---|
| InChI | InChI=1S/C19H29NO/c1-4-5-10-18(20-13-11-15(2)12-14-20)19(21)17-9-7-6-8-16(17)3/h6-9,15,18H,4-5,10-14H2,1-3H3 |
| InChIKey | ZWQRWRMIPIIRDG-UHFFFAOYSA-N |
| Mol Weight | 287.45 g/mol |
| Molecular Formula | C19H29NO |
| Exact Mass | 287.224915 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | OGLCBkx9x8 |
|---|---|
| Name | 1-(2-Methylphenyl)-2-(4-methylpiperidino)hexan-1-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 287.224914557 u |
| Formula | C19H29NO |
| InChI | InChI=1S/C19H29NO/c1-4-5-10-18(20-13-11-15(2)12-14-20)19(21)17-9-7-6-8-16(17)3/h6-9,15,18H,4-5,10-14H2,1-3H3 |
| InChIKey | ZWQRWRMIPIIRDG-UHFFFAOYSA-N |
| SMILES | C(C(C=1C(=CC=CC1)C)=O)(N1CCC(CC1)C)CCCC |