| SpectraBase Compound ID | DRPDcI5RSQ |
|---|---|
| InChI | InChI=1S/C18H16N2O3/c21-16(14-8-3-1-4-9-14)19-12-7-13-20(18(19)23)17(22)15-10-5-2-6-11-15/h1-6,8-11H,7,12-13H2 |
| InChIKey | GJRFJMPJWBNEAF-UHFFFAOYSA-N |
| Mol Weight | 308.34 g/mol |
| Molecular Formula | C18H16N2O3 |
| Exact Mass | 308.116092 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IRK9XNdctii |
|---|---|
| Name | 1,3-Dibenzoyltetrahydro-2-(1H)-pyrimidinone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 308.116092380 u |
| Formula | C18H16N2O3 |
| InChI | InChI=1S/C18H16N2O3/c21-16(14-8-3-1-4-9-14)19-12-7-13-20(18(19)23)17(22)15-10-5-2-6-11-15/h1-6,8-11H,7,12-13H2 |
| InChIKey | GJRFJMPJWBNEAF-UHFFFAOYSA-N |
| Molecular Weight | 308.337 g/mol |
| SMILES | C=1C(=CC=CC1)C(N1CCCN(C1=O)C(C=1C=CC=CC1)=O)=O |