| SpectraBase Compound ID | Hio0QojQAOU |
|---|---|
| InChI | InChI=1S/C14H13N3/c1-10-9-11(2)17(16-10)13-7-3-5-12-6-4-8-15-14(12)13/h3-9H,1-2H3 |
| InChIKey | BSSICVUIJQVDJZ-UHFFFAOYSA-N |
| Mol Weight | 223.28 g/mol |
| Molecular Formula | C14H13N3 |
| Exact Mass | 223.110947 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6lxI1BZPdu9 |
|---|---|
| Name | 8-(3,5-Dimethyl-1H-pyrazol-1-yl)quinoline |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 223.110947431 u |
| Formula | C14H13N3 |
| InChI | InChI=1S/C14H13N3/c1-10-9-11(2)17(16-10)13-7-3-5-12-6-4-8-15-14(12)13/h3-9H,1-2H3 |
| InChIKey | BSSICVUIJQVDJZ-UHFFFAOYSA-N |
| Molecular Weight | 223.279 g/mol |
| SMILES | C=1C=C2C(C(N3N=C(C)C=C3C)=CC=C2)=NC1 |