![urea, N'-(3-chlorophenyl)-N-methyl-N-[2-(2-pyridinyl)ethyl]-](/api/spectrum/4zJ5gtYORUq/structure.png?h=300&w=458 "urea, N'-(3-chlorophenyl)-N-methyl-N-[2-(2-pyridinyl)ethyl]-")
| SpectraBase Compound ID | X6mfEygQ0p |
|---|---|
| InChI | InChI=1S/C15H16ClN3O/c1-19(10-8-13-6-2-3-9-17-13)15(20)18-14-7-4-5-12(16)11-14/h2-7,9,11H,8,10H2,1H3,(H,18,20) |
| InChIKey | XEJICTWMZOEWMN-UHFFFAOYSA-N |
| Mol Weight | 289.77 g/mol |
| Molecular Formula | C15H16ClN3O |
| Exact Mass | 289.09819 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4zJ5gtYORUq |
|---|---|
| Name | Urea, N'-(3-chlorophenyl)-N-methyl-N-[2-(2-pyridinyl)ethyl]- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 289.098189846 u |
| Formula | C15H16ClN3O |
| InChI | InChI=1S/C15H16ClN3O/c1-19(10-8-13-6-2-3-9-17-13)15(20)18-14-7-4-5-12(16)11-14/h2-7,9,11H,8,10H2,1H3,(H,18,20) |
| InChIKey | XEJICTWMZOEWMN-UHFFFAOYSA-N |
| Molecular Weight | 289.766 g/mol |
| SMILES | N(C(N(CCC=1N=CC=CC1)C)=O)C1=CC(Cl)=CC=C1 |