![1H-Indole, 1-[[3-(trifluoromethyl)phenyl]methyl]-](/api/spectrum/6uOoCqil18J/structure.png?h=300&w=458 "1H-Indole, 1-[[3-(trifluoromethyl)phenyl]methyl]-")
| SpectraBase Compound ID | 6c0rkJcx0Tl |
|---|---|
| InChI | InChI=1S/C16H12F3N/c17-16(18,19)14-6-3-4-12(10-14)11-20-9-8-13-5-1-2-7-15(13)20/h1-10H,11H2 |
| InChIKey | QOVXJETZMZTCSD-UHFFFAOYSA-N |
| Mol Weight | 275.27 g/mol |
| Molecular Formula | C16H12F3N |
| Exact Mass | 275.092184 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 6uOoCqil18J |
|---|---|
| Name | 1H-Indole, 1-[[3-(trifluoromethyl)phenyl]methyl]- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 275.092183879 u |
| Formula | C16H12F3N |
| InChI | InChI=1S/C16H12F3N/c17-16(18,19)14-6-3-4-12(10-14)11-20-9-8-13-5-1-2-7-15(13)20/h1-10H,11H2 |
| InChIKey | QOVXJETZMZTCSD-UHFFFAOYSA-N |
| Molecular Weight | 275.274 g/mol |
| SMILES | C1=CC=C2N(C=CC2=C1)CC=1C=C(C(F)(F)F)C=CC1 |