![4-Benzoyl-1,2,3,4-tetrahydrobenzo[F]quinoline-3-carbonitrile](/api/spectrum/F3zMTtCj2zo/structure.png?h=300&w=458 "4-Benzoyl-1,2,3,4-tetrahydrobenzo[F]quinoline-3-carbonitrile")
| SpectraBase Compound ID | DoXhLINfuEI |
|---|---|
| InChI | InChI=1S/C21H16N2O/c22-14-17-11-12-19-18-9-5-4-6-15(18)10-13-20(19)23(17)21(24)16-7-2-1-3-8-16/h1-10,13,17H,11-12H2 |
| InChIKey | AJJHVONVMDVCET-UHFFFAOYSA-N |
| Mol Weight | 312.37 g/mol |
| Molecular Formula | C21H16N2O |
| Exact Mass | 312.126263 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 | F3zMTtCj2zo |
|---|---|
| Name | 4-Benzoyl-1,2,3,4-tetrahydrobenzo[F]quinoline-3-carbonitrile |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 312.126263142 u |
| Formula | C21H16N2O |
| InChI | InChI=1S/C21H16N2O/c22-14-17-11-12-19-18-9-5-4-6-15(18)10-13-20(19)23(17)21(24)16-7-2-1-3-8-16/h1-10,13,17H,11-12H2 |
| InChIKey | AJJHVONVMDVCET-UHFFFAOYSA-N |
| SMILES | C12=CC=C3C=CC=CC3=C1CCC(N2C(C=1C=CC=CC1)=O)C#N |