| SpectraBase Compound ID | CnjYiKBBBPr |
|---|---|
| InChI | InChI=1S/C14H20N2O2/c1-11(16-9-7-15-8-10-16)14(17)12-3-5-13(18-2)6-4-12/h3-6,11,15H,7-10H2,1-2H3 |
| InChIKey | HAEROVBNZLYOOD-UHFFFAOYSA-N |
| Mol Weight | 248.33 g/mol |
| Molecular Formula | C14H20N2O2 |
| Exact Mass | 248.152478 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Cjy4zZ0GxYY |
|---|---|
| Name | 1-(4-Methoxyphenyl)-2-(piperazin-1-yl)propan-1-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 248.152477890 u |
| Formula | C14H20N2O2 |
| InChI | InChI=1S/C14H20N2O2/c1-11(16-9-7-15-8-10-16)14(17)12-3-5-13(18-2)6-4-12/h3-6,11,15H,7-10H2,1-2H3 |
| InChIKey | HAEROVBNZLYOOD-UHFFFAOYSA-N |
| Molecular Weight | 248.326 g/mol |
| SMILES | C1=C(C=CC(=C1)C(C(N1CCNCC1)C)=O)OC |