| SpectraBase Compound ID | ByqjMFlDWP9 |
|---|---|
| InChI | InChI=1S/C13H13ClN4O/c1-8-7-12(16-9(2)15-8)18-13(19)17-11-5-3-10(14)4-6-11/h3-7H,1-2H3,(H2,15,16,17,18,19) |
| InChIKey | XDSSNMADCOOAJQ-UHFFFAOYSA-N |
| Mol Weight | 276.73 g/mol |
| Molecular Formula | C13H13ClN4O |
| Exact Mass | 276.077789 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | SlfJ1Zjzvp |
|---|---|
| Name | Urea, N-(4-chlorophenyl)-N'-(2,6-dimethyl-4-pyrimidinyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 276.077788754 u |
| Formula | C13H13ClN4O |
| InChI | InChI=1S/C13H13ClN4O/c1-8-7-12(16-9(2)15-8)18-13(19)17-11-5-3-10(14)4-6-11/h3-7H,1-2H3,(H2,15,16,17,18,19) |
| InChIKey | XDSSNMADCOOAJQ-UHFFFAOYSA-N |
| SMILES | N(C1=NC(=NC(=C1)C)C)C(NC1=CC=C(C=C1)Cl)=O |