| SpectraBase Compound ID | FQvyjRxzydl |
|---|---|
| InChI | InChI=1S/C16H29NO4/c1-12(2)7-6-10-20-15(18)14-8-5-9-17(14)16(19)21-11-13(3)4/h12-14H,5-11H2,1-4H3 |
| InChIKey | MFIKNLBJGUNPFK-UHFFFAOYSA-N |
| Mol Weight | 299.41 g/mol |
| Molecular Formula | C16H29NO4 |
| Exact Mass | 299.209658 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5o4m8Jp7CSz |
|---|---|
| Name | D-Proline, N-isobutoxycarbonyl-, isohexyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 299.209658414 u |
| Formula | C16H29NO4 |
| InChI | InChI=1S/C16H29NO4/c1-12(2)7-6-10-20-15(18)14-8-5-9-17(14)16(19)21-11-13(3)4/h12-14H,5-11H2,1-4H3 |
| InChIKey | MFIKNLBJGUNPFK-UHFFFAOYSA-N |
| SMILES | C1CC(C(OCCCC(C)C)=O)N(C1)C(=O)OCC(C)C |