| SpectraBase Compound ID | 6epILJbwN46 |
|---|---|
| InChI | InChI=1S/C17H15N3O/c1-12-8-10-15(11-9-12)20-13(2)18-17(21)16(19-20)14-6-4-3-5-7-14/h3-11H,1-2H3 |
| InChIKey | ZUFLSOOFQDGEAE-UHFFFAOYSA-N |
| Mol Weight | 277.33 g/mol |
| Molecular Formula | C17H15N3O |
| Exact Mass | 277.121512 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HH21oQyb5ig |
|---|---|
| Name | 3-Methyl-2-(4-methylphenyl)-6-phenyl-1,2,4-triazin-5(2H)-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 277.121512114 u |
| Formula | C17H15N3O |
| InChI | InChI=1S/C17H15N3O/c1-12-8-10-15(11-9-12)20-13(2)18-17(21)16(19-20)14-6-4-3-5-7-14/h3-11H,1-2H3 |
| InChIKey | ZUFLSOOFQDGEAE-UHFFFAOYSA-N |
| SMILES | C1(=NN(C(=NC1=O)C)C=1C=CC(=CC1)C)C1=CC=CC=C1 |