| SpectraBase Compound ID | 4dhzwUCD2K |
|---|---|
| InChI | InChI=1S/C12H9N3/c1-2-4-12-10(3-1)7-11(8-14-12)15-6-5-13-9-15/h1-9H |
| InChIKey | SRUVTPIFNUPTIR-UHFFFAOYSA-N |
| Mol Weight | 195.22 g/mol |
| Molecular Formula | C12H9N3 |
| Exact Mass | 195.079647 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Me5QblaSVj |
|---|---|
| Name | 3-(1H-Imidazol-1-yl)quinoline |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 195.079647302 u |
| Formula | C12H9N3 |
| InChI | InChI=1S/C12H9N3/c1-2-4-12-10(3-1)7-11(8-14-12)15-6-5-13-9-15/h1-9H |
| InChIKey | SRUVTPIFNUPTIR-UHFFFAOYSA-N |
| Molecular Weight | 195.225 g/mol |
| SMILES | C1=NC2=CC=CC=C2C=C1N1C=CN=C1 |