| SpectraBase Compound ID | GFCK1fYNLDq |
|---|---|
| InChI | InChI=1S/C16H31NO4/c1-6-7-8-9-20-15(18)14(10-12(2)3)17-16(19)21-11-13(4)5/h12-14H,6-11H2,1-5H3,(H,17,19) |
| InChIKey | RQTZQBNPMJZGSQ-UHFFFAOYSA-N |
| Mol Weight | 301.43 g/mol |
| Molecular Formula | C16H31NO4 |
| Exact Mass | 301.225308 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LVKGWmOanF5 |
|---|---|
| Name | L-Leucine, N-isobutoxycarbonyl-, pentyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 301.225308478 u |
| Formula | C16H31NO4 |
| InChI | InChI=1S/C16H31NO4/c1-6-7-8-9-20-15(18)14(10-12(2)3)17-16(19)21-11-13(4)5/h12-14H,6-11H2,1-5H3,(H,17,19) |
| InChIKey | RQTZQBNPMJZGSQ-UHFFFAOYSA-N |
| SMILES | CC(C)COC(NC(C(OCCCCC)=O)CC(C)C)=O |