| SpectraBase Compound ID | GlQzKPoRyas |
|---|---|
| InChI | InChI=1S/C9H10O3/c1-2-12-9-4-3-7(6-10)5-8(9)11/h3-6,11H,2H2,1H3 |
| InChIKey | BCLVKHGKEGFPJV-UHFFFAOYSA-N |
| Mol Weight | 166.18 g/mol |
| Molecular Formula | C9H10O3 |
| Exact Mass | 166.062994 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 3DcKwaY9sW6 |
|---|---|
| Name | Benzaldehyde, 4-ethoxy-3-hydroxy- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 166.062994179 u |
| Formula | C9H10O3 |
| InChI | InChI=1S/C9H10O3/c1-2-12-9-4-3-7(6-10)5-8(9)11/h3-6,11H,2H2,1H3 |
| InChIKey | BCLVKHGKEGFPJV-UHFFFAOYSA-N |
| SMILES | CCOC1=C(O)C=C(C=O)C=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.966493 |