| SpectraBase Compound ID | CXN3uIrnoYA |
|---|---|
| InChI | InChI=1S/C13H9F5O3/c1-8(7-9-5-3-2-4-6-9)10(19)21-11(20)12(14,15)13(16,17)18/h2-7H,1H3 |
| InChIKey | HMPPHDXSJIMGCV-UHFFFAOYSA-N |
| Mol Weight | 308.2 g/mol |
| Molecular Formula | C13H9F5O3 |
| Exact Mass | 308.047185 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LgiPQu9IP7C |
|---|---|
| Name | .alpha.-Methyl cinnamic pentafluoropropionic anhydride |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 308.047184962 u |
| Formula | C13H9F5O3 |
| InChI | InChI=1S/C13H9F5O3/c1-8(7-9-5-3-2-4-6-9)10(19)21-11(20)12(14,15)13(16,17)18/h2-7H,1H3 |
| InChIKey | HMPPHDXSJIMGCV-UHFFFAOYSA-N |
| Molecular Weight | 308.204 g/mol |
| SMILES | C(OC(C(C(F)(F)F)(F)F)=O)(=O)\C(=C\C1=CC=CC=C1)C |