| SpectraBase Compound ID | 9n8G5FnF035 |
|---|---|
| InChI | InChI=1S/C14H11F5O7/c1-6(20)25-10-8(23-2)4-7(5-9(10)24-3)11(21)26-12(22)13(15,16)14(17,18)19/h4-5H,1-3H3 |
| InChIKey | SNSCDIDRVYBMEO-UHFFFAOYSA-N |
| Mol Weight | 386.23 g/mol |
| Molecular Formula | C14H11F5O7 |
| Exact Mass | 386.042494 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9CdP8v1VQtD |
|---|---|
| Name | Acetyl syringic pentafluoropropionic anhydride |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 386.042493502 u |
| Formula | C14H11F5O7 |
| InChI | InChI=1S/C14H11F5O7/c1-6(20)25-10-8(23-2)4-7(5-9(10)24-3)11(21)26-12(22)13(15,16)14(17,18)19/h4-5H,1-3H3 |
| InChIKey | SNSCDIDRVYBMEO-UHFFFAOYSA-N |
| Molecular Weight | 386.227 g/mol |
| SMILES | C1(=C(C(=CC(=C1)C(OC(C(C(F)(F)F)(F)F)=O)=O)OC)OC(C)=O)OC |