| SpectraBase Compound ID | 2RtcF7fnbCN |
|---|---|
| InChI | InChI=1S/C17H11F3O3/c18-17(19,20)16(22)23-14-9-6-12(7-10-14)8-11-15(21)13-4-2-1-3-5-13/h1-11H/b11-8+ |
| InChIKey | XIAHTJMGSVQQDI-DHZHZOJOSA-N |
| Mol Weight | 320.27 g/mol |
| Molecular Formula | C17H11F3O3 |
| Exact Mass | 320.066029 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 83GmVIhXqB9 |
|---|---|
| Name | 4-(Trifluoroacetyl)oxychalcone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 320.066028700 u |
| Formula | C17H11F3O3 |
| InChI | InChI=1S/C17H11F3O3/c18-17(19,20)16(22)23-14-9-6-12(7-10-14)8-11-15(21)13-4-2-1-3-5-13/h1-11H/b11-8+ |
| InChIKey | XIAHTJMGSVQQDI-DHZHZOJOSA-N |
| Molecular Weight | 320.267 g/mol |
| SMILES | C1(=CC=CC=C1)C(\C=C\C=1C=CC(=CC1)OC(C(F)(F)F)=O)=O |