| SpectraBase Compound ID | ENK7KilKBuL |
|---|---|
| InChI | InChI=1S/C9H8F2O2/c1-13-7-4-2-6(3-5-7)8(12)9(10)11/h2-5,9H,1H3 |
| InChIKey | MEHGSTAWEFSOKW-UHFFFAOYSA-N |
| Mol Weight | 186.16 g/mol |
| Molecular Formula | C9H8F2O2 |
| Exact Mass | 186.049236 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | Cm7ngmjwaKk |
|---|---|
| Name | 2,2-Difluoro-1-(4-methoxyphenyl)ethanone |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 186.049235822 u |
| Formula | C9H8F2O2 |
| InChI | InChI=1S/C9H8F2O2/c1-13-7-4-2-6(3-5-7)8(12)9(10)11/h2-5,9H,1H3 |
| InChIKey | MEHGSTAWEFSOKW-UHFFFAOYSA-N |
| Molecular Weight | 186.158 g/mol |
| SMILES | C(C(F)F)(C=1C=CC(=CC1)OC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.948264 |