| SpectraBase Compound ID | 3dyNm5RSC56 |
|---|---|
| InChI | InChI=1S/C14H9ClN2O/c15-10-4-3-5-11(8-10)17-9-16-13-7-2-1-6-12(13)14(17)18/h1-9H |
| InChIKey | FEUHTFJNZUHVHT-UHFFFAOYSA-N |
| Mol Weight | 256.69 g/mol |
| Molecular Formula | C14H9ClN2O |
| Exact Mass | 256.040341 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8BJ2A9C0HVB |
|---|---|
| Name | 3-(3-Chlorophenyl)-4-quinazolinone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 256.040340617 u |
| Formula | C14H9ClN2O |
| InChI | InChI=1S/C14H9ClN2O/c15-10-4-3-5-11(8-10)17-9-16-13-7-2-1-6-12(13)14(17)18/h1-9H |
| InChIKey | FEUHTFJNZUHVHT-UHFFFAOYSA-N |
| Molecular Weight | 256.692 g/mol |
| SMILES | C1=NC=2C=CC=CC2C(N1C=1C=C(C=CC1)Cl)=O |