| SpectraBase Spectrum ID |
LCqAcc5wwOk |
| Name |
4-Chloro-2-(4-fluorophenyl)tetrahydro-2H-pyran |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
214.056070868 u |
| Formula |
C11H12ClFO |
| InChI |
InChI=1S/C11H12ClFO/c12-9-5-6-14-11(7-9)8-1-3-10(13)4-2-8/h1-4,9,11H,5-7H2 |
| InChIKey |
SWCAVBGBCLWIPM-UHFFFAOYSA-N |
| Molecular Weight |
214.667 g/mol |
| SMILES |
C1(CC(CCO1)Cl)C=1C=CC(=CC1)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.945368 |