| SpectraBase Compound ID | KDGS70MIzyA |
|---|---|
| InChI | InChI=1S/C9H16N2O5/c1-4-16-9(14)11-6(2)8(13)10-5-7(12)15-3/h6H,4-5H2,1-3H3,(H,10,13)(H,11,14) |
| InChIKey | HEWAMWLZNIIZGB-UHFFFAOYSA-N |
| Mol Weight | 232.24 g/mol |
| Molecular Formula | C9H16N2O5 |
| Exact Mass | 232.105922 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3Bi8aPK5PP3 |
|---|---|
| Name | ala-gly, N-(Ethoxycarbonyl)-, methyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 232.105921618 u |
| Formula | C9H16N2O5 |
| InChI | InChI=1S/C9H16N2O5/c1-4-16-9(14)11-6(2)8(13)10-5-7(12)15-3/h6H,4-5H2,1-3H3,(H,10,13)(H,11,14) |
| InChIKey | HEWAMWLZNIIZGB-UHFFFAOYSA-N |
| Molecular Weight | 232.236 g/mol |
| SMILES | C(NCC(=O)OC)(=O)C(NC(OCC)=O)C |