| SpectraBase Compound ID | FK2wNfd4SQI |
|---|---|
| InChI | InChI=1S/C16H9F5/c17-12-11(13(18)15(20)16(21)14(12)19)10-6-5-8-3-1-2-4-9(8)7-10/h1-4,7H,5-6H2 |
| InChIKey | WZAOXNAYIBTTHP-UHFFFAOYSA-N |
| Mol Weight | 296.24 g/mol |
| Molecular Formula | C16H9F5 |
| Exact Mass | 296.062441 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4PRsI0x3AQn |
|---|---|
| Name | 3-(Perfluorophenyl)-1,2-dihydronaphthalene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 296.062441105 u |
| Formula | C16H9F5 |
| InChI | InChI=1S/C16H9F5/c17-12-11(13(18)15(20)16(21)14(12)19)10-6-5-8-3-1-2-4-9(8)7-10/h1-4,7H,5-6H2 |
| InChIKey | WZAOXNAYIBTTHP-UHFFFAOYSA-N |
| Molecular Weight | 296.240 g/mol |
| SMILES | C=1(C(=C(C=2CCC=3C(=CC=CC3)C2)C(=C(C1F)F)F)F)F |