| SpectraBase Compound ID | 4NmFtBpwnoF |
|---|---|
| InChI | InChI=1S/C11H7F5O3/c1-6(17)7-2-4-8(5-3-7)19-9(18)10(12,13)11(14,15)16/h2-5H,1H3 |
| InChIKey | ITKLCAYBKAHKIK-UHFFFAOYSA-N |
| Mol Weight | 282.17 g/mol |
| Molecular Formula | C11H7F5O3 |
| Exact Mass | 282.031535 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 | KnvFZxlZymn |
|---|---|
| Name | 4-Acetylphenyl 2,2,3,3,3-pentafluoropropanoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 282.031534897 u |
| Formula | C11H7F5O3 |
| InChI | InChI=1S/C11H7F5O3/c1-6(17)7-2-4-8(5-3-7)19-9(18)10(12,13)11(14,15)16/h2-5H,1H3 |
| InChIKey | ITKLCAYBKAHKIK-UHFFFAOYSA-N |
| Molecular Weight | 282.166 g/mol |
| SMILES | C(OC1=CC=C(C=C1)C(C)=O)(C(C(F)(F)F)(F)F)=O |