| SpectraBase Compound ID | 407spfGzWUd |
|---|---|
| InChI | InChI=1S/C7H4FIO2/c8-6-2-1-4(9)3-5(6)7(10)11/h1-3H,(H,10,11) |
| InChIKey | QNNJHBNTHVHALE-UHFFFAOYSA-N |
| Mol Weight | 266.01 g/mol |
| Molecular Formula | C7H4FIO2 |
| Exact Mass | 265.924003 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | Fh4FIDymwxU |
|---|---|
| Name | 2-Fluoro-5-iodobenzoic acid |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 265.924002530 u |
| Formula | C7H4FIO2 |
| InChI | InChI=1S/C7H4FIO2/c8-6-2-1-4(9)3-5(6)7(10)11/h1-3H,(H,10,11) |
| InChIKey | QNNJHBNTHVHALE-UHFFFAOYSA-N |
| Molecular Weight | 266.010 g/mol |
| SMILES | OC(C=1C(=CC=C(C1)I)F)=O |
| Spectrum/Structure Validation Score (Raman) | 0.701044 |