| SpectraBase Compound ID | 85O4B30HGeN |
|---|---|
| InChI | InChI=1S/C23H43NO4/c1-3-5-7-9-11-15-19-27-22(25)21-17-13-14-18-24(21)23(26)28-20-16-12-10-8-6-4-2/h21H,3-20H2,1-2H3 |
| InChIKey | LASKFZJULSTHDD-UHFFFAOYSA-N |
| Mol Weight | 397.6 g/mol |
| Molecular Formula | C23H43NO4 |
| Exact Mass | 397.319209 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | pYyY4nPYso |
|---|---|
| Name | Pipecolic acid, N-octyloxycarbonyl-, octyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 397.319208865 u |
| Formula | C23H43NO4 |
| InChI | InChI=1S/C23H43NO4/c1-3-5-7-9-11-15-19-27-22(25)21-17-13-14-18-24(21)23(26)28-20-16-12-10-8-6-4-2/h21H,3-20H2,1-2H3 |
| InChIKey | LASKFZJULSTHDD-UHFFFAOYSA-N |
| Molecular Weight | 397.600 g/mol |
| SMILES | C1CCN(C(C1)C(OCCCCCCCC)=O)C(OCCCCCCCC)=O |