| SpectraBase Compound ID | Bq6ugJNHSZ3 |
|---|---|
| InChI | InChI=1S/C16H24N2O2/c1-11-8-13-14(18-11)6-5-7-15(13)20-10-12(19)9-17-16(2,3)4/h5-8,12,17-19H,9-10H2,1-4H3 |
| InChIKey | BGQHPLYSXBZMQG-UHFFFAOYSA-N |
| Mol Weight | 276.38 g/mol |
| Molecular Formula | C16H24N2O2 |
| Exact Mass | 276.183778 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Fe3Hf1rMnOQ |
|---|---|
| Name | Bopindolol-A |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 276.183778019 u |
| Formula | C16H24N2O2 |
| InChI | InChI=1S/C16H24N2O2/c1-11-8-13-14(18-11)6-5-7-15(13)20-10-12(19)9-17-16(2,3)4/h5-8,12,17-19H,9-10H2,1-4H3 |
| InChIKey | BGQHPLYSXBZMQG-UHFFFAOYSA-N |
| SMILES | C12=C(NC(=C2)C)C=CC=C1OCC(CNC(C)(C)C)O |