| SpectraBase Compound ID | 4LX0rKmOuR7 |
|---|---|
| InChI | InChI=1S/C9H7FO2/c10-6-1-2-9-7(5-6)8(11)3-4-12-9/h1-2,5H,3-4H2 |
| InChIKey | SWBBIJZMIGAZHW-UHFFFAOYSA-N |
| Mol Weight | 166.15 g/mol |
| Molecular Formula | C9H7FO2 |
| Exact Mass | 166.043008 g/mol |
Raman Spectrum
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | DUI0PyZprtp |
|---|---|
| Name | 6-Fluoro-4-chromanone |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 166.043007626 u |
| Formula | C9H7FO2 |
| InChI | InChI=1S/C9H7FO2/c10-6-1-2-9-7(5-6)8(11)3-4-12-9/h1-2,5H,3-4H2 |
| InChIKey | SWBBIJZMIGAZHW-UHFFFAOYSA-N |
| Molecular Weight | 166.151 g/mol |
| SMILES | C=12C=C(C=CC1OCCC2=O)F |
| Spectrum/Structure Validation Score (Raman) | 0.92299 |