| SpectraBase Compound ID | 4b4xIvqwzrM |
|---|---|
| InChI | InChI=1S/C12H10ClN3O/c13-9-1-3-10(4-2-9)15-12(17)16-11-5-7-14-8-6-11/h1-8H,(H2,14,15,16,17) |
| InChIKey | AAVUKLGYVIGYKQ-UHFFFAOYSA-N |
| Mol Weight | 247.69 g/mol |
| Molecular Formula | C12H10ClN3O |
| Exact Mass | 247.05124 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3RBrawtb60u |
|---|---|
| Name | N-(4-Chlorophenyl)-N'-(4-pyridinyl)urea |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 247.051239653 u |
| Formula | C12H10ClN3O |
| InChI | InChI=1S/C12H10ClN3O/c13-9-1-3-10(4-2-9)15-12(17)16-11-5-7-14-8-6-11/h1-8H,(H2,14,15,16,17) |
| InChIKey | AAVUKLGYVIGYKQ-UHFFFAOYSA-N |
| SMILES | N(C(=O)NC1=CC=NC=C1)C1=CC=C(C=C1)Cl |