| SpectraBase Compound ID | 3C2nyssAWKQ |
|---|---|
| InChI | InChI=1S/C8H9F2NO/c9-8(10)5-12-7-4-2-1-3-6(7)11/h1-4,8H,5,11H2 |
| InChIKey | BSGRCBDEPUIGKU-UHFFFAOYSA-N |
| Mol Weight | 173.16 g/mol |
| Molecular Formula | C8H9F2NO |
| Exact Mass | 173.06522 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 9ZgBj3U56Gm |
|---|---|
| Name | 2-(2,2-Difluoroethoxy)aniline |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 173.065220239 u |
| Formula | C8H9F2NO |
| InChI | InChI=1S/C8H9F2NO/c9-8(10)5-12-7-4-2-1-3-6(7)11/h1-4,8H,5,11H2 |
| InChIKey | BSGRCBDEPUIGKU-UHFFFAOYSA-N |
| Molecular Weight | 173.163 g/mol |
| SMILES | C(F)(F)COC1=C(C=CC=C1)N |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.94966 |