| SpectraBase Compound ID | 9RhetaCRivj |
|---|---|
| InChI | InChI=1S/C9H10FI/c1-9(10,7-11)8-5-3-2-4-6-8/h2-6H,7H2,1H3 |
| InChIKey | MQYKSLLXSWEUBA-UHFFFAOYSA-N |
| Mol Weight | 264.08 g/mol |
| Molecular Formula | C9H10FI |
| Exact Mass | 263.981123 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 4QE36gE4ZwF |
|---|---|
| Name | (1-Fluoro-2-iodo-1-methyl-ethyl)benzene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 263.981123485 u |
| Formula | C9H10FI |
| InChI | InChI=1S/C9H10FI/c1-9(10,7-11)8-5-3-2-4-6-8/h2-6H,7H2,1H3 |
| InChIKey | MQYKSLLXSWEUBA-UHFFFAOYSA-N |
| Molecular Weight | 264.082 g/mol |
| SMILES | C(C=1C=CC=CC1)(F)(CI)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.872418 |