| SpectraBase Compound ID | 3jQcf1Uu0U2 |
|---|---|
| InChI | InChI=1S/C21H39NO4/c1-3-5-7-9-10-14-18-26-21(24)22-16-12-11-15-19(22)20(23)25-17-13-8-6-4-2/h19H,3-18H2,1-2H3 |
| InChIKey | ORQOTBLGSQXNHL-UHFFFAOYSA-N |
| Mol Weight | 369.5 g/mol |
| Molecular Formula | C21H39NO4 |
| Exact Mass | 369.287909 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HZnDUrSZEPc |
|---|---|
| Name | Pipecolic acid, N-octyloxycarbonyl-, hexyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 369.287908736 u |
| Formula | C21H39NO4 |
| InChI | InChI=1S/C21H39NO4/c1-3-5-7-9-10-14-18-26-21(24)22-16-12-11-15-19(22)20(23)25-17-13-8-6-4-2/h19H,3-18H2,1-2H3 |
| InChIKey | ORQOTBLGSQXNHL-UHFFFAOYSA-N |
| Molecular Weight | 369.546 g/mol |
| SMILES | C1CCN(C(C1)C(OCCCCCC)=O)C(OCCCCCCCC)=O |