| SpectraBase Spectrum ID |
GujegWn3c47 |
| Name |
4-(Trifluoromethoxy)benzyl alcohol, 2-methylpropionate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
262.081678765 u |
| Formula |
C12H13F3O3 |
| InChI |
InChI=1S/C12H13F3O3/c1-8(2)11(16)17-7-9-3-5-10(6-4-9)18-12(13,14)15/h3-6,8H,7H2,1-2H3 |
| InChIKey |
PIFCEPAPMIUYPC-UHFFFAOYSA-N |
| Molecular Weight |
262.228 g/mol |
| SMILES |
C1=CC(=CC=C1COC(C(C)C)=O)OC(F)(F)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.810115 |
