| SpectraBase Compound ID | E839D120nq1 |
|---|---|
| InChI | InChI=1S/C11H20N2O5/c1-5-18-11(16)13-9(7(2)3)10(15)12-6-8(14)17-4/h7,9H,5-6H2,1-4H3,(H,12,15)(H,13,16) |
| InChIKey | MKTNSLNTZIWNLB-UHFFFAOYSA-N |
| Mol Weight | 260.29 g/mol |
| Molecular Formula | C11H20N2O5 |
| Exact Mass | 260.137222 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DN1M6vAxQ4x |
|---|---|
| Name | val-gly, N-Ethoxycarbonyl-. methyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 260.137221747 u |
| Formula | C11H20N2O5 |
| InChI | InChI=1S/C11H20N2O5/c1-5-18-11(16)13-9(7(2)3)10(15)12-6-8(14)17-4/h7,9H,5-6H2,1-4H3,(H,12,15)(H,13,16) |
| InChIKey | MKTNSLNTZIWNLB-UHFFFAOYSA-N |
| Molecular Weight | 260.290 g/mol |
| SMILES | C(C(NC(OCC)=O)C(C)C)(=O)NCC(=O)OC |