![2-Ethyl-3-benzyl-3,4-dihydrobenzo[D]pyrimidin-4-one](/api/spectrum/L6MXNWTFxJu/structure.png?h=300&w=458 "2-Ethyl-3-benzyl-3,4-dihydrobenzo[D]pyrimidin-4-one")
| SpectraBase Compound ID | IFNapHSP6VL |
|---|---|
| InChI | InChI=1S/C17H16N2O/c1-2-16-18-15-11-7-6-10-14(15)17(20)19(16)12-13-8-4-3-5-9-13/h3-11H,2,12H2,1H3 |
| InChIKey | NARRNFVSQSGDNM-UHFFFAOYSA-N |
| Mol Weight | 264.33 g/mol |
| Molecular Formula | C17H16N2O |
| Exact Mass | 264.126263 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | L6MXNWTFxJu |
|---|---|
| Name | 2-Ethyl-3-benzyl-3,4-dihydrobenzo[D]pyrimidin-4-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 264.126263142 u |
| Formula | C17H16N2O |
| InChI | InChI=1S/C17H16N2O/c1-2-16-18-15-11-7-6-10-14(15)17(20)19(16)12-13-8-4-3-5-9-13/h3-11H,2,12H2,1H3 |
| InChIKey | NARRNFVSQSGDNM-UHFFFAOYSA-N |
| Molecular Weight | 264.328 g/mol |
| SMILES | C1(N(C(=Nc2c1cccc2)CC)Cc1ccccc1)=O |