| SpectraBase Spectrum ID |
43etKLk8NbK |
| Name |
Phenol, 2,6-ditert-butyl-4-2,3,4,5,6-pentafluorobenzyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
386.166906175 u |
| Formula |
C21H23F5O |
| InChI |
InChI=1S/C21H23F5O/c1-20(2,3)12-8-10(9-13(19(12)27)21(4,5)6)7-11-14(22)16(24)18(26)17(25)15(11)23/h8-9,27H,7H2,1-6H3 |
| InChIKey |
IKQCUJGEZIWUSM-UHFFFAOYSA-N |
| Molecular Weight |
386.406 g/mol |
| SMILES |
C(C1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C)C1=C(C(=C(C(=C1F)F)F)F)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.877817 |
