| SpectraBase Spectrum ID |
FwHAWLmZ7WD |
| Name |
2-Tert-butyl-4-ethylphenol, o-heptafluorobutyryl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
374.111676926 u |
| Formula |
C16H17F7O2 |
| InChI |
InChI=1S/C16H17F7O2/c1-5-9-6-7-11(10(8-9)13(2,3)4)25-12(24)14(17,18)15(19,20)16(21,22)23/h6-8H,5H2,1-4H3 |
| InChIKey |
FXERWYACQZWJFD-UHFFFAOYSA-N |
| Molecular Weight |
374.299 g/mol |
| SMILES |
C(C)(C)(C)C1=CC(CC)=CC=C1OC(=O)C(C(C(F)(F)F)(F)F)(F)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.896645 |
