![2-[(E)-2-(3-methylphenyl)ethenyl]-4(3H)-quinazolinone](/api/spectrum/8zbDa2jhVzQ/structure.png?h=300&w=458 "2-[(E)-2-(3-methylphenyl)ethenyl]-4(3H)-quinazolinone")
| SpectraBase Compound ID | J4hyqAjyPIO |
|---|---|
| InChI | InChI=1S/C17H14N2O/c1-12-5-4-6-13(11-12)9-10-16-18-15-8-3-2-7-14(15)17(20)19-16/h2-11H,1H3,(H,18,19,20)/b10-9+ |
| InChIKey | BLVJYZMMPDHHHO-MDZDMXLPSA-N |
| Mol Weight | 262.31 g/mol |
| Molecular Formula | C17H14N2O |
| Exact Mass | 262.110613 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8zbDa2jhVzQ |
|---|---|
| Name | 2-[(E)-2-(3-Methylphenyl)ethenyl]-4(3H)-quinazolinone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 262.110613078 u |
| Formula | C17H14N2O |
| InChI | InChI=1S/C17H14N2O/c1-12-5-4-6-13(11-12)9-10-16-18-15-8-3-2-7-14(15)17(20)19-16/h2-11H,1H3,(H,18,19,20)/b10-9+ |
| InChIKey | BLVJYZMMPDHHHO-MDZDMXLPSA-N |
| Molecular Weight | 262.312 g/mol |
| SMILES | N1C(=NC2=C(C1=O)C=CC=C2)\C=C\C1=CC(C)=CC=C1 |