| SpectraBase Compound ID | HSePNU3astA |
|---|---|
| InChI | InChI=1S/C6H3FINO2/c7-5-3-4(9(10)11)1-2-6(5)8/h1-3H |
| InChIKey | QLAFWGDKYKHVKC-UHFFFAOYSA-N |
| Mol Weight | 267.0 g/mol |
| Molecular Formula | C6H3FINO2 |
| Exact Mass | 266.919252 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | Isxl586OJBu |
|---|---|
| Name | 3-Fluoro-4-iodonitrobenzene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 266.919251502 u |
| Formula | C6H3FINO2 |
| InChI | InChI=1S/C6H3FINO2/c7-5-3-4(9(10)11)1-2-6(5)8/h1-3H |
| InChIKey | QLAFWGDKYKHVKC-UHFFFAOYSA-N |
| Molecular Weight | 266.998 g/mol |
| SMILES | C1(I)=C(C=C(C=C1)N(=O)=O)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.926139 |