| SpectraBase Compound ID | 2aveUaImPz9 |
|---|---|
| InChI | InChI=1S/C6H6O5/c7-3-1-6(10)11-4(3)2-5(8)9/h1,4,7H,2H2,(H,8,9) |
| InChIKey | VDVHBZFWTAJSMR-UHFFFAOYSA-N |
| Mol Weight | 158.11 g/mol |
| Molecular Formula | C6H6O5 |
| Exact Mass | 158.021523 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | C5YxQZ6xzaX |
|---|---|
| Name | 2,5-Dihydro-3-hydroxy-5-oxo-2-furanacetic acid |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 158.021523288 u |
| Formula | C6H6O5 |
| InChI | InChI=1S/C6H6O5/c7-3-1-6(10)11-4(3)2-5(8)9/h1,4,7H,2H2,(H,8,9) |
| InChIKey | VDVHBZFWTAJSMR-UHFFFAOYSA-N |
| Molecular Weight | 158.109 g/mol |
| SMILES | OC1=CC(OC1CC(O)=O)=O |
| Spectrum/Structure Validation Score (Raman) | 0.784308 |