| SpectraBase Compound ID | LhvDiIaZQt2 |
|---|---|
| InChI | InChI=1S/C10H9FO/c1-2-3-10(12)8-4-6-9(11)7-5-8/h2,4-7H,1,3H2 |
| InChIKey | PXMFXMMTOGHPDF-UHFFFAOYSA-N |
| Mol Weight | 164.18 g/mol |
| Molecular Formula | C10H9FO |
| Exact Mass | 164.063743 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | B3fAd0WYODN |
|---|---|
| Name | 1-(4-Fluorophenyl)-3-butenone |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 164.063743072 u |
| Formula | C10H9FO |
| InChI | InChI=1S/C10H9FO/c1-2-3-10(12)8-4-6-9(11)7-5-8/h2,4-7H,1,3H2 |
| InChIKey | PXMFXMMTOGHPDF-UHFFFAOYSA-N |
| Molecular Weight | 164.179 g/mol |
| SMILES | C(C1=CC=C(C=C1)F)(=O)CC=C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.94208 |