| SpectraBase Compound ID | H2aQWa5SU1U |
|---|---|
| InChI | InChI=1S/C26H49NO4/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-23-30-25(28)24-20-19-21-27(24)26(29)31-22-6-4-2/h24H,3-23H2,1-2H3 |
| InChIKey | RRXGBPBVZRDSHC-UHFFFAOYSA-N |
| Mol Weight | 439.7 g/mol |
| Molecular Formula | C26H49NO4 |
| Exact Mass | 439.366159 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6ZEx2NgEPi7 |
|---|---|
| Name | L-Proline, N-butoxycarbonyl-, hexadecyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 439.366159058 u |
| Formula | C26H49NO4 |
| InChI | InChI=1S/C26H49NO4/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-23-30-25(28)24-20-19-21-27(24)26(29)31-22-6-4-2/h24H,3-23H2,1-2H3 |
| InChIKey | RRXGBPBVZRDSHC-UHFFFAOYSA-N |
| Molecular Weight | 439.681 g/mol |
| SMILES | C1(N(CCC1)C(=O)OCCCC)C(OCCCCCCCCCCCCCCCC)=O |