| SpectraBase Compound ID | Es5IuGQavLL |
|---|---|
| InChI | InChI=1S/C14H16N2O2/c1-3-15-9-11(2)13(17)16(14(15)18)10-12-7-5-4-6-8-12/h4-9H,3,10H2,1-2H3 |
| InChIKey | WJBITCJVYKRDCT-UHFFFAOYSA-N |
| Mol Weight | 244.29 g/mol |
| Molecular Formula | C14H16N2O2 |
| Exact Mass | 244.121178 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3yjJyeyS9UD |
|---|---|
| Name | 1-Ethyl-5-methyl-3-(phenylmethyl)pyrimidine-2,4-dione |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 244.121177761 u |
| Formula | C14H16N2O2 |
| InChI | InChI=1S/C14H16N2O2/c1-3-15-9-11(2)13(17)16(14(15)18)10-12-7-5-4-6-8-12/h4-9H,3,10H2,1-2H3 |
| InChIKey | WJBITCJVYKRDCT-UHFFFAOYSA-N |
| Molecular Weight | 244.294 g/mol |
| SMILES | C1(N(C(C(=CN1CC)C)=O)CC=1C=CC=CC1)=O |