| SpectraBase Compound ID | EwTvInSkCtH |
|---|---|
| InChI | InChI=1S/C12H6F6O5/c1-5(19)7-3-2-6(22-9(20)11(13,14)15)4-8(7)23-10(21)12(16,17)18/h2-4H,1H3 |
| InChIKey | IOYBIDVLGHFZCQ-UHFFFAOYSA-N |
| Mol Weight | 344.17 g/mol |
| Molecular Formula | C12H6F6O5 |
| Exact Mass | 344.011942 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | Kt0eI16rfQ7 |
|---|---|
| Name | Acetophenone, 2,4-bis(trifluoroacetyloxy)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 344.011942266 u |
| Formula | C12H6F6O5 |
| InChI | InChI=1S/C12H6F6O5/c1-5(19)7-3-2-6(22-9(20)11(13,14)15)4-8(7)23-10(21)12(16,17)18/h2-4H,1H3 |
| InChIKey | IOYBIDVLGHFZCQ-UHFFFAOYSA-N |
| Molecular Weight | 344.165 g/mol |
| SMILES | C1(=CC(=CC=C1C(=O)C)OC(C(F)(F)F)=O)OC(C(F)(F)F)=O |