| SpectraBase Compound ID | IqvIGLMgd0o |
|---|---|
| InChI | InChI=1S/C18H37N3O/c22-18-12-8-6-4-2-1-3-5-7-9-13-19-14-10-15-20-16-11-17-21-18/h19-20H,1-17H2,(H,21,22) |
| InChIKey | AFORVBPPJHKDMW-UHFFFAOYSA-N |
| Mol Weight | 311.5 g/mol |
| Molecular Formula | C18H37N3O |
| Exact Mass | 311.293663 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4WnT688P6f2 |
|---|---|
| Name | 1,5,9-Triazacycloheneicosan-10-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 311.293662822 u |
| Formula | C18H37N3O |
| InChI | InChI=1S/C18H37N3O/c22-18-12-8-6-4-2-1-3-5-7-9-13-19-14-10-15-20-16-11-17-21-18/h19-20H,1-17H2,(H,21,22) |
| InChIKey | AFORVBPPJHKDMW-UHFFFAOYSA-N |
| Molecular Weight | 311.514 g/mol |
| SMILES | C1CNCCCNCCCCCCCCCCCC(NC1)=O |