| SpectraBase Compound ID | 3iFz4OvJYxz |
|---|---|
| InChI | InChI=1S/C9H10F2O2/c1-13-7-4-2-6(3-5-7)8(12)9(10)11/h2-5,8-9,12H,1H3 |
| InChIKey | ISFCVJGNLBFSOB-UHFFFAOYSA-N |
| Mol Weight | 188.17 g/mol |
| Molecular Formula | C9H10F2O2 |
| Exact Mass | 188.064886 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 23Wpz98kW9K |
|---|---|
| Name | 2,2-Difluoro-1-(4-methoxyphenyl)ethanol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 188.064885886 u |
| Formula | C9H10F2O2 |
| InChI | InChI=1S/C9H10F2O2/c1-13-7-4-2-6(3-5-7)8(12)9(10)11/h2-5,8-9,12H,1H3 |
| InChIKey | ISFCVJGNLBFSOB-UHFFFAOYSA-N |
| Molecular Weight | 188.174 g/mol |
| SMILES | C1=CC(OC)=CC=C1C(C(F)F)O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.826363 |