| SpectraBase Compound ID | 5Y0jHlFW5xN |
|---|---|
| InChI | InChI=1S/C14H9N3O3/c18-14-12-3-1-2-4-13(12)15-9-16(14)10-5-7-11(8-6-10)17(19)20/h1-9H |
| InChIKey | RMHYEHAOFXFUIY-UHFFFAOYSA-N |
| Mol Weight | 267.24 g/mol |
| Molecular Formula | C14H9N3O3 |
| Exact Mass | 267.064391 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Fy7Jh2q4yIr |
|---|---|
| Name | 3-(4-Nitrophenyl)-4-quinazolinone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 267.064391159 u |
| Formula | C14H9N3O3 |
| InChI | InChI=1S/C14H9N3O3/c18-14-12-3-1-2-4-13(12)15-9-16(14)10-5-7-11(8-6-10)17(19)20/h1-9H |
| InChIKey | RMHYEHAOFXFUIY-UHFFFAOYSA-N |
| Molecular Weight | 267.244 g/mol |
| SMILES | C1=NC=2C=CC=CC2C(N1C=1C=CC(=CC1)N(=O)=O)=O |