| SpectraBase Compound ID | LQuiP0ZyAHl |
|---|---|
| InChI | InChI=1S/C12H9FINO/c13-8-5-6-12(10(15)7-8)16-11-4-2-1-3-9(11)14/h1-7H,15H2 |
| InChIKey | NFYRCNKNEMUKKU-UHFFFAOYSA-N |
| Mol Weight | 329.11 g/mol |
| Molecular Formula | C12H9FINO |
| Exact Mass | 328.971287 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 4fuy0l7NX6W |
|---|---|
| Name | 5-Fluoro-2-(2-iodophenoxy)aniline |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 328.971287076 u |
| Formula | C12H9FINO |
| InChI | InChI=1S/C12H9FINO/c13-8-5-6-12(10(15)7-8)16-11-4-2-1-3-9(11)14/h1-7H,15H2 |
| InChIKey | NFYRCNKNEMUKKU-UHFFFAOYSA-N |
| Molecular Weight | 329.113 g/mol |
| SMILES | C=1C=C(OC2=CC=C(C=C2N)F)C(I)=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.957776 |