| SpectraBase Compound ID | L2LYoaQndUo |
|---|---|
| InChI | InChI=1S/C20H20N2O2/c21-15-16-6-8-17(9-7-16)19(22-10-12-24-13-11-22)14-20(23)18-4-2-1-3-5-18/h1-9,19H,10-14H2 |
| InChIKey | JDMNWXOBQMPGTD-UHFFFAOYSA-N |
| Mol Weight | 320.39 g/mol |
| Molecular Formula | C20H20N2O2 |
| Exact Mass | 320.152478 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4WPl2sdBWie |
|---|---|
| Name | 3-(4-Cyano)phenyl-3-morpholino-1-phenylpropan-1-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 320.152477890 u |
| Formula | C20H20N2O2 |
| InChI | InChI=1S/C20H20N2O2/c21-15-16-6-8-17(9-7-16)19(22-10-12-24-13-11-22)14-20(23)18-4-2-1-3-5-18/h1-9,19H,10-14H2 |
| InChIKey | JDMNWXOBQMPGTD-UHFFFAOYSA-N |
| Molecular Weight | 320.392 g/mol |
| SMILES | C(C(N1CCOCC1)C=1C=CC(C#N)=CC1)C(=O)C=1C=CC=CC1 |