| SpectraBase Compound ID | GjD0ml1Ly7n |
|---|---|
| InChI | InChI=1S/C20H33NO4/c1-3-5-6-7-8-9-10-13-17-24-19(22)18-14-11-12-15-21(18)20(23)25-16-4-2/h2,18H,3,5-17H2,1H3 |
| InChIKey | LJUWCSVRFVGJFN-UHFFFAOYSA-N |
| Mol Weight | 351.5 g/mol |
| Molecular Formula | C20H33NO4 |
| Exact Mass | 351.240959 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GuAMoQXDauW |
|---|---|
| Name | Pipecolic acid, N-propargyloxycarbonyl-, decyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 351.240958543 u |
| Formula | C20H33NO4 |
| InChI | InChI=1S/C20H33NO4/c1-3-5-6-7-8-9-10-13-17-24-19(22)18-14-11-12-15-21(18)20(23)25-16-4-2/h2,18H,3,5-17H2,1H3 |
| InChIKey | LJUWCSVRFVGJFN-UHFFFAOYSA-N |
| Molecular Weight | 351.487 g/mol |
| SMILES | C1CCN(C(C1)C(OCCCCCCCCCC)=O)C(OCC#C)=O |