| SpectraBase Compound ID | CCYBv3wALoO |
|---|---|
| InChI | InChI=1S/C18H15FO3/c1-12-3-5-14(6-4-12)7-9-17(21)16-11-15(19)8-10-18(16)22-13(2)20/h3-11H,1-2H3/b9-7+ |
| InChIKey | LKPLKDMVRDTEIZ-VQHVLOKHSA-N |
| Mol Weight | 298.31 g/mol |
| Molecular Formula | C18H15FO3 |
| Exact Mass | 298.100523 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4fD6O0f24py |
|---|---|
| Name | 5'-Fluoro-2'-(acetyl)oxy-4-methylchalcone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 298.100522503 u |
| Formula | C18H15FO3 |
| InChI | InChI=1S/C18H15FO3/c1-12-3-5-14(6-4-12)7-9-17(21)16-11-15(19)8-10-18(16)22-13(2)20/h3-11H,1-2H3/b9-7+ |
| InChIKey | LKPLKDMVRDTEIZ-VQHVLOKHSA-N |
| Molecular Weight | 298.313 g/mol |
| SMILES | C1(=CC(=CC=C1OC(C)=O)F)C(\C=C\C1=CC=C(C=C1)C)=O |