| SpectraBase Compound ID | 1dOYxzi96IH |
|---|---|
| InChI | InChI=1S/C23H45N3O2/c24-17-10-11-18-25-19-13-21-26-20-12-9-15-22(27)14-7-5-3-1-2-4-6-8-16-23(26)28/h25H,1-21,24H2 |
| InChIKey | GUXIRJSJKKRGKL-UHFFFAOYSA-N |
| Mol Weight | 395.6 g/mol |
| Molecular Formula | C23H45N3O2 |
| Exact Mass | 395.351178 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GGVNMSrprsq |
|---|---|
| Name | 1-(8'-Amino-4'-azaoctyl)-1-azacycloheptadecane-2,13-dione |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 395.351177699 u |
| Formula | C23H45N3O2 |
| InChI | InChI=1S/C23H45N3O2/c24-17-10-11-18-25-19-13-21-26-20-12-9-15-22(27)14-7-5-3-1-2-4-6-8-16-23(26)28/h25H,1-21,24H2 |
| InChIKey | GUXIRJSJKKRGKL-UHFFFAOYSA-N |
| Molecular Weight | 395.632 g/mol |
| SMILES | C1CCN(C(CCCCCCCCCCC(=O)C1)=O)CCCNCCCCN |