| SpectraBase Compound ID | Et8vCEdpO3B |
|---|---|
| InChI | InChI=1S/C8H8O3/c1-6-7(3-2-4-9)5-8(10)11-6/h4-5H,1-3H2 |
| InChIKey | FLKVVVWYZIFCFB-UHFFFAOYSA-N |
| Mol Weight | 152.15 g/mol |
| Molecular Formula | C8H8O3 |
| Exact Mass | 152.047344 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 6tEFzPolmUk |
|---|---|
| Name | 3-(2-Methylene-5-oxo-3-furanyl)propanal |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 152.047344115 u |
| Formula | C8H8O3 |
| InChI | InChI=1S/C8H8O3/c1-6-7(3-2-4-9)5-8(10)11-6/h4-5H,1-3H2 |
| InChIKey | FLKVVVWYZIFCFB-UHFFFAOYSA-N |
| Molecular Weight | 152.149 g/mol |
| SMILES | C1(OC(=O)C=C1CCC=O)=C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.965659 |