| SpectraBase Compound ID | GFSJU3o1wiI |
|---|---|
| InChI | InChI=1S/C11H4F6O5/c12-10(13,14)8(19)21-6-3-1-5(2-4-6)7(18)22-9(20)11(15,16)17/h1-4H |
| InChIKey | UPIJEAGCYJIKHJ-UHFFFAOYSA-N |
| Mol Weight | 330.14 g/mol |
| Molecular Formula | C11H4F6O5 |
| Exact Mass | 329.996292 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5MYJs3eBdMS |
|---|---|
| Name | 4-(Trifluoroacetyloxy)benzoic trifluoroacetic anhydride |
| Comments | Computed using HOSE algorithm |
| 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)21-6-3-1-5(2-4-6)7(18)22-9(20)11(15,16)17/h1-4H |
| InChIKey | UPIJEAGCYJIKHJ-UHFFFAOYSA-N |
| Molecular Weight | 330.138 g/mol |
| SMILES | C1=CC(=CC=C1C(=O)OC(C(F)(F)F)=O)OC(C(F)(F)F)=O |