| SpectraBase Compound ID | 1eSjrogcBrS |
|---|---|
| InChI | InChI=1S/C8H5F3O/c9-7(10)8(11)12-6-4-2-1-3-5-6/h1-5H |
| InChIKey | HVUFSELLSNXJCA-UHFFFAOYSA-N |
| Mol Weight | 174.12 g/mol |
| Molecular Formula | C8H5F3O |
| Exact Mass | 174.029249 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | B3HmiBbY2j4 |
|---|---|
| Name | 1,2,2-Trifluoroethenoxybenzene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 174.029249269 u |
| Formula | C8H5F3O |
| InChI | InChI=1S/C8H5F3O/c9-7(10)8(11)12-6-4-2-1-3-5-6/h1-5H |
| InChIKey | HVUFSELLSNXJCA-UHFFFAOYSA-N |
| Molecular Weight | 174.122 g/mol |
| SMILES | C(=C(F)F)(OC1=CC=CC=C1)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.92447 |