| SpectraBase Compound ID | GxzohftE5XM |
|---|---|
| InChI | InChI=1S/C10H8FNO/c1-6-3-2-4-7-5-8(11)10(13)12-9(6)7/h2-5H,1H3,(H,12,13) |
| InChIKey | DXAGQQAUDWLTAA-UHFFFAOYSA-N |
| Mol Weight | 177.18 g/mol |
| Molecular Formula | C10H8FNO |
| Exact Mass | 177.058992 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 896dVevmIPl |
|---|---|
| Name | 3-Fluoro-8-methylquinolin-2(1H)-one |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 177.058992044 u |
| Formula | C10H8FNO |
| InChI | InChI=1S/C10H8FNO/c1-6-3-2-4-7-5-8(11)10(13)12-9(6)7/h2-5H,1H3,(H,12,13) |
| InChIKey | DXAGQQAUDWLTAA-UHFFFAOYSA-N |
| Molecular Weight | 177.178 g/mol |
| SMILES | C1(NC2=C(C=C1F)C=CC=C2C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.879722 |