| SpectraBase Spectrum ID |
JY23MJD58sT |
| Name |
2-[2-(4-Fluorohenylethyl)]tetrahydro-2H-pyran |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
208.126343329 u |
| Formula |
C13H17FO |
| InChI |
InChI=1S/C13H17FO/c14-12-7-4-11(5-8-12)6-9-13-3-1-2-10-15-13/h4-5,7-8,13H,1-3,6,9-10H2 |
| InChIKey |
PUSZTCYIVFPWST-UHFFFAOYSA-N |
| Molecular Weight |
208.276 g/mol |
| SMILES |
C1(OCCCC1)CCC=1C=CC(=CC1)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.838187 |