| SpectraBase Compound ID | 7aRO2k2imX1 |
|---|---|
| InChI | InChI=1S/C8H7FN2O3/c1-5(12)10-7-3-2-6(9)4-8(7)11(13)14/h2-4H,1H3,(H,10,12) |
| InChIKey | UZBZEUCQENVPQB-UHFFFAOYSA-N |
| Mol Weight | 198.15 g/mol |
| Molecular Formula | C8H7FN2O3 |
| Exact Mass | 198.04407 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 1FkWTPTYJjV |
|---|---|
| Name | 4'-Fluoro-2'-nitroacetanilide |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 198.044070253 u |
| Formula | C8H7FN2O3 |
| InChI | InChI=1S/C8H7FN2O3/c1-5(12)10-7-3-2-6(9)4-8(7)11(13)14/h2-4H,1H3,(H,10,12) |
| InChIKey | UZBZEUCQENVPQB-UHFFFAOYSA-N |
| Molecular Weight | 198.153 g/mol |
| SMILES | N(C1=CC=C(C=C1N(=O)=O)F)C(C)=O |
| Spectrum/Structure Validation Score (Raman) | 0.966837 |