| SpectraBase Compound ID | Egsj1xbHTom |
|---|---|
| InChI | InChI=1S/C9H6FNO/c10-7-5-6-3-1-2-4-8(6)11-9(7)12/h1-5H,(H,11,12) |
| InChIKey | FRFSUUWVTVDAJG-UHFFFAOYSA-N |
| Mol Weight | 163.15 g/mol |
| Molecular Formula | C9H6FNO |
| Exact Mass | 163.043342 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 1M4VBEHGH9Z |
|---|---|
| Name | 3-Fluoranyl-1H-quinolin-2-one |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 163.043341979 u |
| Formula | C9H6FNO |
| InChI | InChI=1S/C9H6FNO/c10-7-5-6-3-1-2-4-8(6)11-9(7)12/h1-5H,(H,11,12) |
| InChIKey | FRFSUUWVTVDAJG-UHFFFAOYSA-N |
| Molecular Weight | 163.151 g/mol |
| SMILES | C1(NC=2C=CC=CC2C=C1F)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.857796 |