| SpectraBase Compound ID | 7KrkDvMsL9G |
|---|---|
| InChI | InChI=1S/C22H41NO4/c1-3-5-6-7-8-9-10-11-12-13-16-19-27-21(24)20-17-14-15-18-23(20)22(25)26-4-2/h20H,3-19H2,1-2H3 |
| InChIKey | IKUQJIBCOLJLRH-UHFFFAOYSA-N |
| Mol Weight | 383.6 g/mol |
| Molecular Formula | C22H41NO4 |
| Exact Mass | 383.303559 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CFKqa4flXjQ |
|---|---|
| Name | Pipecolic acid, N-ethoxycarbonyl-, tridecyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 383.303558800 u |
| Formula | C22H41NO4 |
| InChI | InChI=1S/C22H41NO4/c1-3-5-6-7-8-9-10-11-12-13-16-19-27-21(24)20-17-14-15-18-23(20)22(25)26-4-2/h20H,3-19H2,1-2H3 |
| InChIKey | IKUQJIBCOLJLRH-UHFFFAOYSA-N |
| Molecular Weight | 383.573 g/mol |
| SMILES | C1CCN(C(C1)C(OCCCCCCCCCCCCC)=O)C(OCC)=O |