| SpectraBase Compound ID | 1inUYOdwWyh |
|---|---|
| InChI | InChI=1S/C12H23NO5/c1-9(2)8-18-11(14)10(3)13(4)12(15)17-7-6-16-5/h9-10H,6-8H2,1-5H3 |
| InChIKey | GWFLGYBPVWDUFG-UHFFFAOYSA-N |
| Mol Weight | 261.32 g/mol |
| Molecular Formula | C12H23NO5 |
| Exact Mass | 261.157623 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4ermaNqhMZG |
|---|---|
| Name | Alanine, N-methyl-N-(2-methoxyethoxycarbonyl)-, isobutyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 261.157622840 u |
| Formula | C12H23NO5 |
| InChI | InChI=1S/C12H23NO5/c1-9(2)8-18-11(14)10(3)13(4)12(15)17-7-6-16-5/h9-10H,6-8H2,1-5H3 |
| InChIKey | GWFLGYBPVWDUFG-UHFFFAOYSA-N |
| Molecular Weight | 261.318 g/mol |
| SMILES | COCCOC(=O)N(C(C)C(OCC(C)C)=O)C |