| SpectraBase Compound ID | 3f41BMsPIuS |
|---|---|
| InChI | InChI=1S/C21H17N3O/c25-21-18-13-7-8-14-19(18)23-20(15-22-16-9-3-1-4-10-16)24(21)17-11-5-2-6-12-17/h1-14,22H,15H2 |
| InChIKey | XFHRNEODJPUODD-UHFFFAOYSA-N |
| Mol Weight | 327.39 g/mol |
| Molecular Formula | C21H17N3O |
| Exact Mass | 327.137162 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BHUDuKI515n |
|---|---|
| Name | 2-(Anilinomethyl)-3-phenyl-4(3H)-quinazolinone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 327.137162178 u |
| Formula | C21H17N3O |
| InChI | InChI=1S/C21H17N3O/c25-21-18-13-7-8-14-19(18)23-20(15-22-16-9-3-1-4-10-16)24(21)17-11-5-2-6-12-17/h1-14,22H,15H2 |
| InChIKey | XFHRNEODJPUODD-UHFFFAOYSA-N |
| SMILES | N(CC=1N(C(C=2C=CC=CC2N1)=O)C1=CC=CC=C1)C1=CC=CC=C1 |