| SpectraBase Spectrum ID |
FkmS3EMki6j |
| Name |
4-Fluorophenethyl alcohol, chlorodifluoroacetate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
252.016491685 u |
| Formula |
C10H8ClF3O2 |
| InChI |
InChI=1S/C10H8ClF3O2/c11-10(13,14)9(15)16-6-5-7-1-3-8(12)4-2-7/h1-4H,5-6H2 |
| InChIKey |
RTDRSPCRZVJSCH-UHFFFAOYSA-N |
| Molecular Weight |
252.620 g/mol |
| SMILES |
C1=CC(=CC=C1CCOC(C(F)(F)Cl)=O)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.957497 |
