| SpectraBase Compound ID | 64sfIMXbBS0 |
|---|---|
| InChI | InChI=1S/C16H23NO4/c1-12(2)17-9-15(21-11-17)10-20-14-6-4-13(5-7-14)8-16(18)19-3/h4-7,12,15H,8-11H2,1-3H3 |
| InChIKey | AWYNTDCMAFSRMN-UHFFFAOYSA-N |
| Mol Weight | 293.36 g/mol |
| Molecular Formula | C16H23NO4 |
| Exact Mass | 293.162708 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | C2bX1uMmd2h |
|---|---|
| Name | Atenolol artifact (formyl-hooc) me P864 |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 293.162708221 u |
| Formula | C16H23NO4 |
| InChI | InChI=1S/C16H23NO4/c1-12(2)17-9-15(21-11-17)10-20-14-6-4-13(5-7-14)8-16(18)19-3/h4-7,12,15H,8-11H2,1-3H3 |
| InChIKey | AWYNTDCMAFSRMN-UHFFFAOYSA-N |
| SMILES | C=1C(=CC=C(C1)CC(OC)=O)OCC1CN(C(C)C)CO1 |