| SpectraBase Compound ID | LEiZzNa2lLc |
|---|---|
| InChI | InChI=1S/C17H33NO4/c1-5-7-9-10-11-12-14-21-16(19)15(3)18(4)17(20)22-13-8-6-2/h15H,5-14H2,1-4H3 |
| InChIKey | ZKUBKUMUCPASBL-UHFFFAOYSA-N |
| Mol Weight | 315.5 g/mol |
| Molecular Formula | C17H33NO4 |
| Exact Mass | 315.240959 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1v2N0QpoKXK |
|---|---|
| Name | Alanine, N-methyl-N-butoxycarbonyl-, octyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 315.240958543 u |
| Formula | C17H33NO4 |
| InChI | InChI=1S/C17H33NO4/c1-5-7-9-10-11-12-14-21-16(19)15(3)18(4)17(20)22-13-8-6-2/h15H,5-14H2,1-4H3 |
| InChIKey | ZKUBKUMUCPASBL-UHFFFAOYSA-N |
| Molecular Weight | 315.454 g/mol |
| SMILES | CCCCOC(N(C(C(OCCCCCCCC)=O)C)C)=O |