| SpectraBase Compound ID | IkCkBiuXlBF |
|---|---|
| InChI | InChI=1S/C10H11F/c11-10-7-3-5-8-4-1-2-6-9(8)10/h3,5,7H,1-2,4,6H2 |
| InChIKey | HSYLVNKVCLHAAY-UHFFFAOYSA-N |
| Mol Weight | 150.2 g/mol |
| Molecular Formula | C10H11F |
| Exact Mass | 150.084479 g/mol |
| SpectraBase Spectrum ID | 7KwWRebVbtk |
|---|---|
| Name | 3-Fluorbenzocyclohexan |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 150.084478517 u |
| Formula | C10H11F |
| InChI | InChI=1S/C10H11F/c11-10-7-3-5-8-4-1-2-6-9(8)10/h3,5,7H,1-2,4,6H2 |
| InChIKey | HSYLVNKVCLHAAY-UHFFFAOYSA-N |
| Molecular Weight | 150.196 g/mol |
| SMILES | C1(F)=C2C(=CC=C1)CCCC2 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.94299 |