| SpectraBase Spectrum ID |
2kLYcTnJExj |
| Name |
3-(Trifluoroacetyloxy)benzoic trifluoroacetic anhydride |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
329.996292202 u |
| Formula |
C11H4F6O5 |
| InChI |
InChI=1S/C11H4F6O5/c12-10(13,14)8(19)21-6-3-1-2-5(4-6)7(18)22-9(20)11(15,16)17/h1-4H |
| InChIKey |
QOQCOHFUGYJITO-UHFFFAOYSA-N |
| Molecular Weight |
330.138 g/mol |
| SMILES |
C1=CC=C(C=C1C(=O)OC(C(F)(F)F)=O)OC(C(F)(F)F)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.98276 |
