| SpectraBase Compound ID | AcLvaycmEUX |
|---|---|
| InChI | InChI=1S/C13H22N2O5/c1-4-8-20-12(17)10-6-5-7-15(10)11(16)9(2)14-13(18)19-3/h9-10H,4-8H2,1-3H3,(H,14,18) |
| InChIKey | OQKAMFQYRIYUCK-UHFFFAOYSA-N |
| Mol Weight | 286.33 g/mol |
| Molecular Formula | C13H22N2O5 |
| Exact Mass | 286.152872 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AE8SpUKm93a |
|---|---|
| Name | L-Alanyl-L-proline, N-methoxycarbonyl-, propyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 286.152871811 u |
| Formula | C13H22N2O5 |
| InChI | InChI=1S/C13H22N2O5/c1-4-8-20-12(17)10-6-5-7-15(10)11(16)9(2)14-13(18)19-3/h9-10H,4-8H2,1-3H3,(H,14,18) |
| InChIKey | OQKAMFQYRIYUCK-UHFFFAOYSA-N |
| SMILES | C(C(NC(OC)=O)C)(=O)N1CCCC1C(OCCC)=O |