| SpectraBase Compound ID | LYi0Gg8rZ8H |
|---|---|
| InChI | InChI=1S/C10H12O2/c1-8(7-11)9-3-5-10(12-2)6-4-9/h3-8H,1-2H3 |
| InChIKey | JDZPCXLQZLJIPR-UHFFFAOYSA-N |
| Mol Weight | 164.2 g/mol |
| Molecular Formula | C10H12O2 |
| Exact Mass | 164.08373 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | LtE8Ys3ZfhB |
|---|---|
| Name | 2-(4-Methoxyphenyl)propanal |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 164.083729624 u |
| Formula | C10H12O2 |
| InChI | InChI=1S/C10H12O2/c1-8(7-11)9-3-5-10(12-2)6-4-9/h3-8H,1-2H3 |
| InChIKey | JDZPCXLQZLJIPR-UHFFFAOYSA-N |
| Molecular Weight | 164.204 g/mol |
| SMILES | C(C(C)C=1C=CC(=CC1)OC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.94064 |