![2-Phenyl-3-[4-(trifluoromethyl)phenyl]-1H-indole](/api/spectrum/AekOZeJ7T5F/structure.png?h=300&w=458 "2-Phenyl-3-[4-(trifluoromethyl)phenyl]-1H-indole")
| SpectraBase Compound ID | ExnyVncLiW0 |
|---|---|
| InChI | InChI=1S/C21H14F3N/c22-21(23,24)16-12-10-14(11-13-16)19-17-8-4-5-9-18(17)25-20(19)15-6-2-1-3-7-15/h1-13,25H |
| InChIKey | LJNSBUJGTCKXQL-UHFFFAOYSA-N |
| Mol Weight | 337.35 g/mol |
| Molecular Formula | C21H14F3N |
| Exact Mass | 337.107834 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AekOZeJ7T5F |
|---|---|
| Name | 2-Phenyl-3-[4-(trifluoromethyl)phenyl]-1H-indole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 337.107833944 u |
| Formula | C21H14F3N |
| InChI | InChI=1S/C21H14F3N/c22-21(23,24)16-12-10-14(11-13-16)19-17-8-4-5-9-18(17)25-20(19)15-6-2-1-3-7-15/h1-13,25H |
| InChIKey | LJNSBUJGTCKXQL-UHFFFAOYSA-N |
| Molecular Weight | 337.345 g/mol |
| SMILES | C=1(NC=2C=CC=CC2C1C=1C=CC(=CC1)C(F)(F)F)C=1C=CC=CC1 |