| SpectraBase Compound ID | 75rXxc4oZbW |
|---|---|
| InChI | InChI=1S/C6H4FNO3/c7-4-1-2-6(9)5(3-4)8(10)11/h1-3,9H |
| InChIKey | ZHRLVDHMIJDWSS-UHFFFAOYSA-N |
| Mol Weight | 157.1 g/mol |
| Molecular Formula | C6H4FNO3 |
| Exact Mass | 157.017521 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | okbTiH4Gwt |
|---|---|
| Name | 4-Fluoro-2-nitrophenol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 157.017521153 u |
| Formula | C6H4FNO3 |
| InChI | InChI=1S/C6H4FNO3/c7-4-1-2-6(9)5(3-4)8(10)11/h1-3,9H |
| InChIKey | ZHRLVDHMIJDWSS-UHFFFAOYSA-N |
| Molecular Weight | 157.100 g/mol |
| SMILES | C=1(O)C=CC(=CC1N(=O)=O)F |
| Spectrum/Structure Validation Score (Raman) | 0.86228 |