| SpectraBase Compound ID | 8ZzmcL5VBfw |
|---|---|
| InChI | InChI=1S/C14H27NO5/c1-5-7-8-19-13(16)12(11(3)6-2)15-14(17)20-10-9-18-4/h11-12H,5-10H2,1-4H3,(H,15,17) |
| InChIKey | YKUWDEMICHOXSV-UHFFFAOYSA-N |
| Mol Weight | 289.37 g/mol |
| Molecular Formula | C14H27NO5 |
| Exact Mass | 289.188923 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | L9F4cteei2g |
|---|---|
| Name | L-Isoleucine, N-(2-methoxyethoxycarbonyl)-, butyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 289.188922968 u |
| Formula | C14H27NO5 |
| InChI | InChI=1S/C14H27NO5/c1-5-7-8-19-13(16)12(11(3)6-2)15-14(17)20-10-9-18-4/h11-12H,5-10H2,1-4H3,(H,15,17) |
| InChIKey | YKUWDEMICHOXSV-UHFFFAOYSA-N |
| SMILES | C(OCCOC)(NC(C(OCCCC)=O)C(C)CC)=O |