| SpectraBase Compound ID | Dy60aeBu8P4 |
|---|---|
| InChI | InChI=1S/C17H33NO5/c1-4-6-8-9-11-15(16(19)22-12-10-7-5-2)18-17(20)23-14-13-21-3/h15H,4-14H2,1-3H3,(H,18,20) |
| InChIKey | OTWFYDCUJLTHGI-UHFFFAOYSA-N |
| Mol Weight | 331.5 g/mol |
| Molecular Formula | C17H33NO5 |
| Exact Mass | 331.235873 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2HCuyclABAk |
|---|---|
| Name | 2-Aminocaprylic acid, N-(2-methoxyethylcarbonyl)-, pentyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 331.235873162 u |
| Formula | C17H33NO5 |
| InChI | InChI=1S/C17H33NO5/c1-4-6-8-9-11-15(16(19)22-12-10-7-5-2)18-17(20)23-14-13-21-3/h15H,4-14H2,1-3H3,(H,18,20) |
| InChIKey | OTWFYDCUJLTHGI-UHFFFAOYSA-N |
| Molecular Weight | 331.453 g/mol |
| SMILES | COCCOC(NC(C(OCCCCC)=O)CCCCCC)=O |