| SpectraBase Compound ID | 3hVVMawXKHc |
|---|---|
| InChI | InChI=1S/C16H14N2O/c1-11-6-5-9-15(12(11)2)18-10-17-14-8-4-3-7-13(14)16(18)19/h3-10H,1-2H3 |
| InChIKey | PUBSJKWUHVAYQB-UHFFFAOYSA-N |
| Mol Weight | 250.3 g/mol |
| Molecular Formula | C16H14N2O |
| Exact Mass | 250.110613 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BFkKC3UMZ3m |
|---|---|
| Name | 3-(2,3-Dimethylphenyl)quinazolin-4(3H)-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 250.110613078 u |
| Formula | C16H14N2O |
| InChI | InChI=1S/C16H14N2O/c1-11-6-5-9-15(12(11)2)18-10-17-14-8-4-3-7-13(14)16(18)19/h3-10H,1-2H3 |
| InChIKey | PUBSJKWUHVAYQB-UHFFFAOYSA-N |
| Molecular Weight | 250.301 g/mol |
| SMILES | C1=CC=C2C(=C1)C(N(C=N2)C1=CC=CC(=C1C)C)=O |