| SpectraBase Compound ID | 8166qETlFYK |
|---|---|
| InChI | InChI=1S/C21H41NO4/c1-6-8-9-10-11-12-13-14-15-16-17-26-19(23)18(21(3,4)5)22-20(24)25-7-2/h18H,6-17H2,1-5H3,(H,22,24) |
| InChIKey | BHQXGFYLAVXCEN-UHFFFAOYSA-N |
| Mol Weight | 371.6 g/mol |
| Molecular Formula | C21H41NO4 |
| Exact Mass | 371.303559 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2jIUSuXtJVV |
|---|---|
| Name | Tert-leucine, N-ethoxycarbonyl-, dodecyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 371.303558800 u |
| Formula | C21H41NO4 |
| InChI | InChI=1S/C21H41NO4/c1-6-8-9-10-11-12-13-14-15-16-17-26-19(23)18(21(3,4)5)22-20(24)25-7-2/h18H,6-17H2,1-5H3,(H,22,24) |
| InChIKey | BHQXGFYLAVXCEN-UHFFFAOYSA-N |
| Molecular Weight | 371.562 g/mol |
| SMILES | C(C(NC(OCC)=O)C(C)(C)C)(=O)OCCCCCCCCCCCC |