| SpectraBase Compound ID | F6bBnITGhEs |
|---|---|
| InChI | InChI=1S/C9H8O5/c10-6-2-1-5(3-7(6)11)4-8(12)9(13)14/h1-4,10-12H,(H,13,14)/b8-4- |
| InChIKey | LEVWXDHUVBDUSV-YWEYNIOJSA-N |
| Mol Weight | 196.16 g/mol |
| Molecular Formula | C9H8O5 |
| Exact Mass | 196.037173 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IV8IoxZykaX |
|---|---|
| Name | 2-Hydroxy-3-(3,4-dihydroxyphenyl)prop-2-enoic acid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 196.037173353 u |
| Formula | C9H8O5 |
| InChI | InChI=1S/C9H8O5/c10-6-2-1-5(3-7(6)11)4-8(12)9(13)14/h1-4,10-12H,(H,13,14)/b8-4- |
| InChIKey | LEVWXDHUVBDUSV-YWEYNIOJSA-N |
| Molecular Weight | 196.158 g/mol |
| SMILES | C(\C(=C\C=1C=C(C(=CC1)O)O)O)(=O)O |