| SpectraBase Compound ID | 1RAIWY0djfn |
|---|---|
| InChI | InChI=1S/C16H15FO/c1-11(12(2)18)14-8-9-15(16(17)10-14)13-6-4-3-5-7-13/h3-11H,1-2H3 |
| InChIKey | NSQGOLBAOJUBSR-UHFFFAOYSA-N |
| Mol Weight | 242.29 g/mol |
| Molecular Formula | C16H15FO |
| Exact Mass | 242.110693 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4981NfIStLd |
|---|---|
| Name | 3-(3-Fluoranyl-4-phenyl-phenyl)butan-2-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 242.110693265 u |
| Formula | C16H15FO |
| InChI | InChI=1S/C16H15FO/c1-11(12(2)18)14-8-9-15(16(17)10-14)13-6-4-3-5-7-13/h3-11H,1-2H3 |
| InChIKey | NSQGOLBAOJUBSR-UHFFFAOYSA-N |
| Molecular Weight | 242.293 g/mol |
| SMILES | C=1(C(=CC=C(C1)C(C(=O)C)C)C1=CC=CC=C1)F |