| SpectraBase Compound ID | FQILfNhf2vA |
|---|---|
| InChI | InChI=1S/C21H39NO4/c1-4-5-6-7-8-9-10-13-16-25-20(23)19-14-11-12-15-22(19)21(24)26-17-18(2)3/h18-19H,4-17H2,1-3H3 |
| InChIKey | FWZMHEJXOOINFT-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 | 6eAtDkXALbV |
|---|---|
| Name | Pipecolic acid, N-isobutoxycarbonyl-, decyl 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/c1-4-5-6-7-8-9-10-13-16-25-20(23)19-14-11-12-15-22(19)21(24)26-17-18(2)3/h18-19H,4-17H2,1-3H3 |
| InChIKey | FWZMHEJXOOINFT-UHFFFAOYSA-N |
| Molecular Weight | 369.546 g/mol |
| SMILES | C1CCN(C(C1)C(OCCCCCCCCCC)=O)C(OCC(C)C)=O |