| SpectraBase Spectrum ID |
LfmoUnvj7Qe |
| Name |
4-(Trifluoromethoxy)benzyl alcohol, chlorodifluoroacetate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
303.992562565 u |
| Formula |
C10H6ClF5O3 |
| InChI |
InChI=1S/C10H6ClF5O3/c11-9(12,13)8(17)18-5-6-1-3-7(4-2-6)19-10(14,15)16/h1-4H,5H2 |
| InChIKey |
IRTYVEHJIQWZHV-UHFFFAOYSA-N |
| Molecular Weight |
304.600 g/mol |
| SMILES |
C1=CC(=CC=C1COC(C(F)(F)Cl)=O)OC(F)(F)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.913036 |
