| SpectraBase Compound ID | zKuGgE7zbc |
|---|---|
| InChI | InChI=1S/C10H11NO5/c1-16-8(13)5-11-10(15)6-3-2-4-7(12)9(6)14/h2-4,12,14H,5H2,1H3,(H,11,15) |
| InChIKey | SZDNRALMRXRORE-UHFFFAOYSA-N |
| Mol Weight | 225.2 g/mol |
| Molecular Formula | C10H11NO5 |
| Exact Mass | 225.063722 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4sOY7JBSgsP |
|---|---|
| Name | (2,3-Dihydroxybenzoylamino)acetic acid, methyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 225.063722453 u |
| Formula | C10H11NO5 |
| InChI | InChI=1S/C10H11NO5/c1-16-8(13)5-11-10(15)6-3-2-4-7(12)9(6)14/h2-4,12,14H,5H2,1H3,(H,11,15) |
| InChIKey | SZDNRALMRXRORE-UHFFFAOYSA-N |
| Molecular Weight | 225.200 g/mol |
| SMILES | C1(O)=C(C(=O)NCC(OC)=O)C=CC=C1O |