| SpectraBase Compound ID | J0UgWeHkj2t |
|---|---|
| InChI | InChI=1S/C15H29NO5/c1-5-7-8-9-20-14(17)13(12(3)6-2)16-15(18)21-11-10-19-4/h12-13H,5-11H2,1-4H3,(H,16,18) |
| InChIKey | QWJFWBHEFFYTEO-UHFFFAOYSA-N |
| Mol Weight | 303.4 g/mol |
| Molecular Formula | C15H29NO5 |
| Exact Mass | 303.204573 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JDeqh9zjdYR |
|---|---|
| Name | L-Isoleucine, N-(2-methoxyethoxycarbonyl)-, pentyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 303.204573033 u |
| Formula | C15H29NO5 |
| InChI | InChI=1S/C15H29NO5/c1-5-7-8-9-20-14(17)13(12(3)6-2)16-15(18)21-11-10-19-4/h12-13H,5-11H2,1-4H3,(H,16,18) |
| InChIKey | QWJFWBHEFFYTEO-UHFFFAOYSA-N |
| SMILES | CCCCCOC(C(NC(OCCOC)=O)C(C)CC)=O |