![3-[(2,2-Diethoxyethyl)amino]-5-phenylcyclohex-2-en-1-one](/api/spectrum/K31XJYAIdcW/structure.png?h=300&w=458 "3-[(2,2-Diethoxyethyl)amino]-5-phenylcyclohex-2-en-1-one")
| SpectraBase Compound ID | 8f9GjdlzL2v |
|---|---|
| InChI | InChI=1S/C18H25NO3/c1-3-21-18(22-4-2)13-19-16-10-15(11-17(20)12-16)14-8-6-5-7-9-14/h5-9,12,15,18-19H,3-4,10-11,13H2,1-2H3 |
| InChIKey | LXEAJWCKUJQWGX-UHFFFAOYSA-N |
| Mol Weight | 303.4 g/mol |
| Molecular Formula | C18H25NO3 |
| Exact Mass | 303.183444 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | K31XJYAIdcW |
|---|---|
| Name | 3-[(2,2-Diethoxyethyl)amino]-5-phenylcyclohex-2-en-1-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 303.183443666 u |
| Formula | C18H25NO3 |
| InChI | InChI=1S/C18H25NO3/c1-3-21-18(22-4-2)13-19-16-10-15(11-17(20)12-16)14-8-6-5-7-9-14/h5-9,12,15,18-19H,3-4,10-11,13H2,1-2H3 |
| InChIKey | LXEAJWCKUJQWGX-UHFFFAOYSA-N |
| SMILES | C1=C(CC(CC1=O)C1=CC=CC=C1)NCC(OCC)OCC |