| SpectraBase Compound ID | I07JAeInomZ |
|---|---|
| InChI | InChI=1S/C15H9F3/c16-15(17,18)12-7-8-14-11(9-12)6-5-10-3-1-2-4-13(10)14/h1-9H |
| InChIKey | RFYQVKWVPKAERV-UHFFFAOYSA-N |
| Mol Weight | 246.23 g/mol |
| Molecular Formula | C15H9F3 |
| Exact Mass | 246.065635 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3GzX85HEvWE |
|---|---|
| Name | 2-(Trifluoromethyl)phenanthrene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 246.065634779 u |
| Formula | C15H9F3 |
| InChI | InChI=1S/C15H9F3/c16-15(17,18)12-7-8-14-11(9-12)6-5-10-3-1-2-4-13(10)14/h1-9H |
| InChIKey | RFYQVKWVPKAERV-UHFFFAOYSA-N |
| Molecular Weight | 246.232 g/mol |
| SMILES | C1=C2C=C(C=CC2=C2C(C=CC=C2)=C1)C(F)(F)F |