| SpectraBase Spectrum ID |
IywjhAMER8g |
| Name |
1-(3,4-Dimethoxyphenyl)-2,2,2-trifluoroethanol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
236.066028700 u |
| Formula |
C10H11F3O3 |
| InChI |
InChI=1S/C10H11F3O3/c1-15-7-4-3-6(5-8(7)16-2)9(14)10(11,12)13/h3-5,9,14H,1-2H3 |
| InChIKey |
QJIGHVHBCKDJTB-UHFFFAOYSA-N |
| Molecular Weight |
236.190 g/mol |
| SMILES |
C(C(C=1C=C(OC)C(=CC1)OC)O)(F)(F)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.966236 |
