| SpectraBase Compound ID | K2QK9Y91QoD |
|---|---|
| InChI | InChI=1S/C12H17ClN2O/c1-12(2,3)15-11(16)14-8-9-5-4-6-10(13)7-9/h4-7H,8H2,1-3H3,(H2,14,15,16) |
| InChIKey | DBBDLJBJSHSEAA-UHFFFAOYSA-N |
| Mol Weight | 240.73 g/mol |
| Molecular Formula | C12H17ClN2O |
| Exact Mass | 240.102941 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BAXGT8CxRtD |
|---|---|
| Name | N-(Tert-butyl)-N'-(3-chlorobenzyl)urea |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 240.102940874 u |
| Formula | C12H17ClN2O |
| InChI | InChI=1S/C12H17ClN2O/c1-12(2,3)15-11(16)14-8-9-5-4-6-10(13)7-9/h4-7H,8H2,1-3H3,(H2,14,15,16) |
| InChIKey | DBBDLJBJSHSEAA-UHFFFAOYSA-N |
| Molecular Weight | 240.734 g/mol |
| SMILES | N(C(NCC1=CC(Cl)=CC=C1)=O)C(C)(C)C |