![3-[2-(4-pyridyl)ethyl]-4(3H)-quinazolinone](/api/spectrum/3MfSUKuORgq/structure.png?h=300&w=458 "3-[2-(4-pyridyl)ethyl]-4(3H)-quinazolinone")
| SpectraBase Compound ID | 3ccb8UyEHMK |
|---|---|
| InChI | InChI=1S/C15H13N3O/c19-15-13-3-1-2-4-14(13)17-11-18(15)10-7-12-5-8-16-9-6-12/h1-6,8-9,11H,7,10H2 |
| InChIKey | SGKYOBOFCJAJDT-UHFFFAOYSA-N |
| Mol Weight | 251.29 g/mol |
| Molecular Formula | C15H13N3O |
| Exact Mass | 251.105862 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3MfSUKuORgq |
|---|---|
| Name | 3-[2-(4-Pyridyl)ethyl]-4(3H)-quinazolinone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 251.105862050 u |
| Formula | C15H13N3O |
| InChI | InChI=1S/C15H13N3O/c19-15-13-3-1-2-4-14(13)17-11-18(15)10-7-12-5-8-16-9-6-12/h1-6,8-9,11H,7,10H2 |
| InChIKey | SGKYOBOFCJAJDT-UHFFFAOYSA-N |
| Molecular Weight | 251.289 g/mol |
| SMILES | C=12C=CC=CC1N=CN(C2=O)CCC=1C=CN=CC1 |