| SpectraBase Compound ID | HwL3MLrW9VL |
|---|---|
| InChI | InChI=1S/C22H37NO4/c1-3-5-6-7-8-9-10-11-12-15-19-26-21(24)20-16-13-14-17-23(20)22(25)27-18-4-2/h2,20H,3,5-19H2,1H3 |
| InChIKey | LBBZUICWOZLAEQ-UHFFFAOYSA-N |
| Mol Weight | 379.5 g/mol |
| Molecular Formula | C22H37NO4 |
| Exact Mass | 379.272259 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GO6UQWfF7xg |
|---|---|
| Name | Pipecolic acid, N-propargyloxycarbonyl-, dodecyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 379.272258671 u |
| Formula | C22H37NO4 |
| InChI | InChI=1S/C22H37NO4/c1-3-5-6-7-8-9-10-11-12-15-19-26-21(24)20-16-13-14-17-23(20)22(25)27-18-4-2/h2,20H,3,5-19H2,1H3 |
| InChIKey | LBBZUICWOZLAEQ-UHFFFAOYSA-N |
| Molecular Weight | 379.541 g/mol |
| SMILES | C1CCN(C(C1)C(OCCCCCCCCCCCC)=O)C(OCC#C)=O |