| SpectraBase Compound ID | HgN6Y8CnrSJ |
|---|---|
| InChI | InChI=1S/C17H33NO4/c1-6-7-8-9-10-11-12-21-16(19)15(4)18(5)17(20)22-13-14(2)3/h14-15H,6-13H2,1-5H3 |
| InChIKey | SHAHCEGUMNBCJC-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 | EGrl3tw1PnO |
|---|---|
| Name | Alanine, N-methyl-N-isobutoxycarbonyl-, 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/c1-6-7-8-9-10-11-12-21-16(19)15(4)18(5)17(20)22-13-14(2)3/h14-15H,6-13H2,1-5H3 |
| InChIKey | SHAHCEGUMNBCJC-UHFFFAOYSA-N |
| Molecular Weight | 315.454 g/mol |
| SMILES | CC(COC(N(C(C(OCCCCCCCC)=O)C)C)=O)C |