| SpectraBase Compound ID | 9FxIeN86JzE |
|---|---|
| InChI | InChI=1S/C10H16N2O5/c1-6(11-10(16)17-2)8(13)12-5-3-4-7(12)9(14)15/h6-7H,3-5H2,1-2H3,(H,11,16)(H,14,15) |
| InChIKey | VJRUEGWCUQWQAO-UHFFFAOYSA-N |
| Mol Weight | 244.25 g/mol |
| Molecular Formula | C10H16N2O5 |
| Exact Mass | 244.105922 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9OM38iUbjO3 |
|---|---|
| Name | ala-pro, N-Methoxycarbonyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 244.105921618 u |
| Formula | C10H16N2O5 |
| InChI | InChI=1S/C10H16N2O5/c1-6(11-10(16)17-2)8(13)12-5-3-4-7(12)9(14)15/h6-7H,3-5H2,1-2H3,(H,11,16)(H,14,15) |
| InChIKey | VJRUEGWCUQWQAO-UHFFFAOYSA-N |
| Molecular Weight | 244.247 g/mol |
| SMILES | C(=O)(C(NC(OC)=O)C)N1C(C(=O)O)CCC1 |