| SpectraBase Compound ID | WEuwMBvlFn |
|---|---|
| InChI | InChI=1S/C14H16O2/c1-3-10-14(12-15,16-11-4-2)13-8-6-5-7-9-13/h3-9,12H,1-2,10-11H2 |
| InChIKey | YTMCJTQYOKXPRM-UHFFFAOYSA-N |
| Mol Weight | 216.28 g/mol |
| Molecular Formula | C14H16O2 |
| Exact Mass | 216.11503 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 7uSSf8nJ2cF |
|---|---|
| Name | 2-Allyloxy-2-phenyl-pent-4-enal |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 216.115029753 u |
| Formula | C14H16O2 |
| InChI | InChI=1S/C14H16O2/c1-3-10-14(12-15,16-11-4-2)13-8-6-5-7-9-13/h3-9,12H,1-2,10-11H2 |
| InChIKey | YTMCJTQYOKXPRM-UHFFFAOYSA-N |
| Molecular Weight | 216.280 g/mol |
| SMILES | C(C1=CC=CC=C1)(C=O)(OCC=C)CC=C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.969742 |