| SpectraBase Compound ID | 8Wp9agJFerP |
|---|---|
| InChI | InChI=1S/C20H39NO5/c1-5-7-8-9-10-11-12-13-14-25-19(22)18(17(3)6-2)21-20(23)26-16-15-24-4/h17-18H,5-16H2,1-4H3,(H,21,23) |
| InChIKey | IVPBVCQYNZIFCX-UHFFFAOYSA-N |
| Mol Weight | 373.5 g/mol |
| Molecular Formula | C20H39NO5 |
| Exact Mass | 373.282823 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 45d2LdD6xyq |
|---|---|
| Name | L-Isoleucine, N-(2-methoxyethoxycarbonyl)-, decyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 373.282823355 u |
| Formula | C20H39NO5 |
| InChI | InChI=1S/C20H39NO5/c1-5-7-8-9-10-11-12-13-14-25-19(22)18(17(3)6-2)21-20(23)26-16-15-24-4/h17-18H,5-16H2,1-4H3,(H,21,23) |
| InChIKey | IVPBVCQYNZIFCX-UHFFFAOYSA-N |
| Molecular Weight | 373.534 g/mol |
| SMILES | C(OC(C(NC(OCCOC)=O)C(C)CC)=O)CCCCCCCCC |