| SpectraBase Compound ID | ApvFeev8iAN |
|---|---|
| InChI | InChI=1S/C8H10O/c1-7-4-2-3-5-8(7)6-9/h2-4,6,8H,5H2,1H3 |
| InChIKey | JZJPLYNDVXJYKZ-UHFFFAOYSA-N |
| Mol Weight | 122.17 g/mol |
| Molecular Formula | C8H10O |
| Exact Mass | 122.073165 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 8W6PblHM3hZ |
|---|---|
| Name | Dihydrotolualdehyde |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 122.073164941 u |
| Formula | C8H10O |
| InChI | InChI=1S/C8H10O/c1-7-4-2-3-5-8(7)6-9/h2-4,6,8H,5H2,1H3 |
| InChIKey | JZJPLYNDVXJYKZ-UHFFFAOYSA-N |
| Molecular Weight | 122.167 g/mol |
| SMILES | C1(=CC=CCC1C=O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.934139 |