| SpectraBase Compound ID | iBM2oSk7mI |
|---|---|
| InChI | InChI=1S/C16H15N3O2/c20-19(21)15-10-8-14(9-11-15)18-12-4-7-16(17-18)13-5-2-1-3-6-13/h1-3,5-6,8-11H,4,7,12H2 |
| InChIKey | GQYWSMCKIOMLFF-UHFFFAOYSA-N |
| Mol Weight | 281.31 g/mol |
| Molecular Formula | C16H15N3O2 |
| Exact Mass | 281.116427 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CViwNPjySCW |
|---|---|
| Name | 1-(4-Nitrophenyl)-3-phenyl-5,6-dihydro-4H-pyridazine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 281.116426733 u |
| Formula | C16H15N3O2 |
| InChI | InChI=1S/C16H15N3O2/c20-19(21)15-10-8-14(9-11-15)18-12-4-7-16(17-18)13-5-2-1-3-6-13/h1-3,5-6,8-11H,4,7,12H2 |
| InChIKey | GQYWSMCKIOMLFF-UHFFFAOYSA-N |
| SMILES | C1=CC=C(C=C1)C=1CCCN(C2=CC=C(C=C2)N(=O)=O)N1 |