| SpectraBase Compound ID | Iu8FBO2TO7Q |
|---|---|
| InChI | InChI=1S/C22H28N2O2/c25-21(17-19-11-7-9-15-23-19)13-5-3-1-2-4-6-14-22(26)18-20-12-8-10-16-24-20/h7-12,15-16H,1-6,13-14,17-18H2 |
| InChIKey | SZYZUZGUGIFMQL-UHFFFAOYSA-N |
| Mol Weight | 352.48 g/mol |
| Molecular Formula | C22H28N2O2 |
| Exact Mass | 352.215078 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CYi7hXtCMe3 |
|---|---|
| Name | 1,12-di(2-Pyridyl)dodecan-2,11-dione |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 352.215078148 u |
| Formula | C22H28N2O2 |
| InChI | InChI=1S/C22H28N2O2/c25-21(17-19-11-7-9-15-23-19)13-5-3-1-2-4-6-14-22(26)18-20-12-8-10-16-24-20/h7-12,15-16H,1-6,13-14,17-18H2 |
| InChIKey | SZYZUZGUGIFMQL-UHFFFAOYSA-N |
| Molecular Weight | 352.478 g/mol |
| SMILES | C(C(CCCCCCCCC(CC=1C=CC=CN1)=O)=O)C=1C=CC=CN1 |