| SpectraBase Compound ID | FxZ6ddqOULk |
|---|---|
| InChI | InChI=1S/C12H17ClN2O/c1-3-4-8-14-12(16)15-11-9(2)6-5-7-10(11)13/h5-7H,3-4,8H2,1-2H3,(H2,14,15,16) |
| InChIKey | JFFYBBBWSGVOIY-UHFFFAOYSA-N |
| Mol Weight | 240.73 g/mol |
| Molecular Formula | C12H17ClN2O |
| Exact Mass | 240.102941 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
Subscribe to view the full spectrum.
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | HhTALIppRVF |
|---|---|
| Name | 1-Butyl-3-(6-chloro-o-tolyl)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/c1-3-4-8-14-12(16)15-11-9(2)6-5-7-10(11)13/h5-7H,3-4,8H2,1-2H3,(H2,14,15,16) |
| InChIKey | JFFYBBBWSGVOIY-UHFFFAOYSA-N |
| Molecular Weight | 240.734 g/mol |
| SMILES | N(C1=C(C=CC=C1Cl)C)C(NCCCC)=O |