| SpectraBase Compound ID | GPaq20Goy18 |
|---|---|
| InChI | InChI=1S/C10H10O2/c1-12-10(7-8-11)9-5-3-2-4-6-9/h2-8H,1H3/b10-7- |
| InChIKey | WKMQLZRKOBTONZ-YFHOEESVSA-N |
| Mol Weight | 162.19 g/mol |
| Molecular Formula | C10H10O2 |
| Exact Mass | 162.06808 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | BKBnjO9w1An |
|---|---|
| Name | (Z)-3-Methoxy-3-phenyl-2-propenal |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 162.068079560 u |
| Formula | C10H10O2 |
| InChI | InChI=1S/C10H10O2/c1-12-10(7-8-11)9-5-3-2-4-6-9/h2-8H,1H3/b10-7- |
| InChIKey | WKMQLZRKOBTONZ-YFHOEESVSA-N |
| Molecular Weight | 162.188 g/mol |
| SMILES | C(\C=C\(C=1C=CC=CC1)OC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.970145 |