![3-[2-(2,4-dichlorophenyl)-2-oxoethyl]quinazolin-4(3H)-one](/api/spectrum/DekdkTiRxNB/structure.png?h=300&w=458 "3-[2-(2,4-dichlorophenyl)-2-oxoethyl]quinazolin-4(3H)-one")
| SpectraBase Compound ID | 6wcFSIbsVuu |
|---|---|
| InChI | InChI=1S/C16H10Cl2N2O2/c17-10-5-6-11(13(18)7-10)15(21)8-20-9-19-14-4-2-1-3-12(14)16(20)22/h1-7,9H,8H2 |
| InChIKey | YHHYTAPYWAPOPT-UHFFFAOYSA-N |
| Mol Weight | 333.17 g/mol |
| Molecular Formula | C16H10Cl2N2O2 |
| Exact Mass | 332.011933 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
Subscribe to view the full spectrum.
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | DekdkTiRxNB |
|---|---|
| Name | 3-[2-(2,4-Dichlorophenyl)-2-oxoethyl]quinazolin-4(3H)-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 332.011932968 u |
| Formula | C16H10Cl2N2O2 |
| InChI | InChI=1S/C16H10Cl2N2O2/c17-10-5-6-11(13(18)7-10)15(21)8-20-9-19-14-4-2-1-3-12(14)16(20)22/h1-7,9H,8H2 |
| InChIKey | YHHYTAPYWAPOPT-UHFFFAOYSA-N |
| Molecular Weight | 333.174 g/mol |
| SMILES | C=1C=CC=2C(N(C=NC2C1)CC(C1=C(C=C(C=C1)Cl)Cl)=O)=O |