| SpectraBase Compound ID | G5p2yGEYucd |
|---|---|
| InChI | InChI=1S/C8F8O2/c9-1-2(10)4(12)6(5(13)3(1)11)18-7(17)8(14,15)16 |
| InChIKey | VCQURUZYYSOUHP-UHFFFAOYSA-N |
| Mol Weight | 280.07 g/mol |
| Molecular Formula | C8F8O2 |
| Exact Mass | 279.977055 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 3VaKfwQsEBR |
|---|---|
| Name | Pentafluorophenyl trifluoroacetate |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 279.977054542 u |
| Formula | C8F8O2 |
| InChI | InChI=1S/C8F8O2/c9-1-2(10)4(12)6(5(13)3(1)11)18-7(17)8(14,15)16 |
| InChIKey | VCQURUZYYSOUHP-UHFFFAOYSA-N |
| Molecular Weight | 280.073 g/mol |
| SMILES | C(F)(C(=O)OC1=C(C(=C(C(=C1F)F)F)F)F)(F)F |
| Spectrum/Structure Validation Score (Raman) | 0.905011 |