| SpectraBase Compound ID | 5rHUoLXZk3l |
|---|---|
| InChI | InChI=1S/C12H23NO4/c1-5-7-9-16-11(14)10(3)13(4)12(15)17-8-6-2/h10H,5-9H2,1-4H3 |
| InChIKey | UQZAHCQORLVYFL-UHFFFAOYSA-N |
| Mol Weight | 245.32 g/mol |
| Molecular Formula | C12H23NO4 |
| Exact Mass | 245.162708 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | nUXvCey74c |
|---|---|
| Name | Alanine, N-methyl-N-propoxycarbonyl-, butyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 245.162708221 u |
| Formula | C12H23NO4 |
| InChI | InChI=1S/C12H23NO4/c1-5-7-9-16-11(14)10(3)13(4)12(15)17-8-6-2/h10H,5-9H2,1-4H3 |
| InChIKey | UQZAHCQORLVYFL-UHFFFAOYSA-N |
| Molecular Weight | 245.319 g/mol |
| SMILES | CCCOC(N(C(C(OCCCC)=O)C)C)=O |