| SpectraBase Compound ID | Hh9YK1QOxtj |
|---|---|
| InChI | InChI=1S/C12H22N2O5/c1-4-6-7-9(11(16)18-3)14-10(15)8-13-12(17)19-5-2/h9H,4-8H2,1-3H3,(H,13,17)(H,14,15) |
| InChIKey | VUHDDNQAVTYARV-UHFFFAOYSA-N |
| Mol Weight | 274.32 g/mol |
| Molecular Formula | C12H22N2O5 |
| Exact Mass | 274.152872 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | F6qvTE2pb7I |
|---|---|
| Name | gly-L-nle, N-(Ethoxycarbonyl)-, methyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 274.152871811 u |
| Formula | C12H22N2O5 |
| InChI | InChI=1S/C12H22N2O5/c1-4-6-7-9(11(16)18-3)14-10(15)8-13-12(17)19-5-2/h9H,4-8H2,1-3H3,(H,13,17)(H,14,15) |
| InChIKey | VUHDDNQAVTYARV-UHFFFAOYSA-N |
| Molecular Weight | 274.317 g/mol |
| SMILES | C(C(NC(=O)CNC(OCC)=O)C(=O)OC)CCC |