| SpectraBase Compound ID | 3r9fUO8lPjP |
|---|---|
| InChI | InChI=1S/C14H18N2O6/c1-21-12(18)7-15-13(19)11(8-17)16-14(20)22-9-10-5-3-2-4-6-10/h2-6,11,17H,7-9H2,1H3,(H,15,19)(H,16,20) |
| InChIKey | XTWNJYQZGKQPMP-UHFFFAOYSA-N |
| Mol Weight | 310.31 g/mol |
| Molecular Formula | C14H18N2O6 |
| Exact Mass | 310.116486 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 76fKJLZtKz2 |
|---|---|
| Name | N-Carbobenzyloxy-serylglycine methyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 310.116486302 u |
| Formula | C14H18N2O6 |
| InChI | InChI=1S/C14H18N2O6/c1-21-12(18)7-15-13(19)11(8-17)16-14(20)22-9-10-5-3-2-4-6-10/h2-6,11,17H,7-9H2,1H3,(H,15,19)(H,16,20) |
| InChIKey | XTWNJYQZGKQPMP-UHFFFAOYSA-N |
| Molecular Weight | 310.306 g/mol |
| SMILES | C1(=CC=CC=C1)COC(NC(CO)C(NCC(OC)=O)=O)=O |