| SpectraBase Compound ID | 734EvSsq9xa |
|---|---|
| InChI | InChI=1S/C17H7F5O4/c18-16(19,17(20,21)22)15(25)26-8-5-6-11-12(7-8)14(24)10-4-2-1-3-9(10)13(11)23/h1-7H |
| InChIKey | ZKVDKVNESIRNSU-UHFFFAOYSA-N |
| Mol Weight | 370.23 g/mol |
| Molecular Formula | C17H7F5O4 |
| Exact Mass | 370.02645 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KE3nBrFZuJH |
|---|---|
| Name | 2-Hydroxyanthraquinone, pentafluoropropionate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 370.026449516 u |
| Formula | C17H7F5O4 |
| InChI | InChI=1S/C17H7F5O4/c18-16(19,17(20,21)22)15(25)26-8-5-6-11-12(7-8)14(24)10-4-2-1-3-9(10)13(11)23/h1-7H |
| InChIKey | ZKVDKVNESIRNSU-UHFFFAOYSA-N |
| Molecular Weight | 370.231 g/mol |
| SMILES | C1(OC(C(C(F)(F)F)(F)F)=O)=CC2=C(C=C1)C(=O)C=1C(C2=O)=CC=CC1 |