| SpectraBase Compound ID | 98VhEmRgdtL |
|---|---|
| InChI | InChI=1S/C16H30N2O2/c1-3-4-5-6-7-10-15-13-16(20)17-11-8-9-12-18(15)14(2)19/h15H,3-13H2,1-2H3,(H,17,20) |
| InChIKey | FQGVBMTZSGXSBB-UHFFFAOYSA-N |
| Mol Weight | 282.43 g/mol |
| Molecular Formula | C16H30N2O2 |
| Exact Mass | 282.230728 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5eHSKAod4qs |
|---|---|
| Name | 5-Acetyl-4-heptyl-1,5-diazacyclononan-2-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 282.230728212 u |
| Formula | C16H30N2O2 |
| InChI | InChI=1S/C16H30N2O2/c1-3-4-5-6-7-10-15-13-16(20)17-11-8-9-12-18(15)14(2)19/h15H,3-13H2,1-2H3,(H,17,20) |
| InChIKey | FQGVBMTZSGXSBB-UHFFFAOYSA-N |
| SMILES | C1(N(CCCCNC(C1)=O)C(=O)C)CCCCCCC |