![4,7,13,16,22-Pentaoxa-1,10-diazabicyclo[8.8.7]-pentacosane](/api/spectrum/5Au2J1gyr5M/structure.png?h=300&w=458 "4,7,13,16,22-Pentaoxa-1,10-diazabicyclo[8.8.7]-pentacosane")
| SpectraBase Compound ID | CkD8U2yzEfw |
|---|---|
| InChI | InChI=1S/C18H36N2O5/c1-3-19-5-11-22-15-17-24-13-7-20(4-2-10-21-9-1)8-14-25-18-16-23-12-6-19/h1-18H2 |
| InChIKey | PZLLSDKIBVWMHW-UHFFFAOYSA-N |
| Mol Weight | 360.5 g/mol |
| Molecular Formula | C18H36N2O5 |
| Exact Mass | 360.262422 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5Au2J1gyr5M |
|---|---|
| Name | 4,7,13,16,22-Pentaoxa-1,10-diazabicyclo[8.8.7]-pentacosane |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 360.262422262 u |
| Formula | C18H36N2O5 |
| InChI | InChI=1S/C18H36N2O5/c1-3-19-5-11-22-15-17-24-13-7-20(4-2-10-21-9-1)8-14-25-18-16-23-12-6-19/h1-18H2 |
| InChIKey | PZLLSDKIBVWMHW-UHFFFAOYSA-N |
| Molecular Weight | 360.495 g/mol |
| SMILES | C1N2CCOCCOCCN(CCOCCOC1)CCCOCCC2 |