| SpectraBase Compound ID | B6t188bjz9A |
|---|---|
| InChI | InChI=1S/C25H47NO4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22-30-24(27)23-20-19-21-26(23)25(28)29-2/h23H,3-22H2,1-2H3 |
| InChIKey | CKZJTSNWBODILS-UHFFFAOYSA-N |
| Mol Weight | 425.7 g/mol |
| Molecular Formula | C25H47NO4 |
| Exact Mass | 425.350509 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | K40FjAzobQ5 |
|---|---|
| Name | L-Proline, N-methoxycarbonyl-, octadecyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 425.350508993 u |
| Formula | C25H47NO4 |
| InChI | InChI=1S/C25H47NO4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22-30-24(27)23-20-19-21-26(23)25(28)29-2/h23H,3-22H2,1-2H3 |
| InChIKey | CKZJTSNWBODILS-UHFFFAOYSA-N |
| Molecular Weight | 425.654 g/mol |
| SMILES | C1(N(CCC1)C(=O)OC)C(OCCCCCCCCCCCCCCCCCC)=O |