| SpectraBase Compound ID | 4zfzqLAGwcM |
|---|---|
| InChI | InChI=1S/C7H6O4/c8-3-4-1-5(9)7(11)6(10)2-4/h1-3,9-11H |
| InChIKey | RGZHEOWNTDJLAQ-UHFFFAOYSA-N |
| Mol Weight | 154.12 g/mol |
| Molecular Formula | C7H6O4 |
| Exact Mass | 154.026609 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | GJ1pE0P1Wnt |
|---|---|
| Name | 3,4,5-Trihydroxybenzaldehyde |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 154.026608669 u |
| Formula | C7H6O4 |
| InChI | InChI=1S/C7H6O4/c8-3-4-1-5(9)7(11)6(10)2-4/h1-3,9-11H |
| InChIKey | RGZHEOWNTDJLAQ-UHFFFAOYSA-N |
| Molecular Weight | 154.121 g/mol |
| SMILES | C(=O)C1=CC(=C(C(=C1)O)O)O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.911434 |