| SpectraBase Spectrum ID |
1ndt3HNcqeH |
| Name |
2-Hydroxyphenethyl alcohol, di(trifluoroacetate) |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
330.032677712 u |
| Formula |
C12H8F6O4 |
| InChI |
InChI=1S/C12H8F6O4/c13-11(14,15)9(19)21-6-5-7-3-1-2-4-8(7)22-10(20)12(16,17)18/h1-4H,5-6H2 |
| InChIKey |
JXWONWDHTVCIDK-UHFFFAOYSA-N |
| Molecular Weight |
330.182 g/mol |
| SMILES |
C1(=C(C=CC=C1)OC(C(F)(F)F)=O)CCOC(C(F)(F)F)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.930851 |
