| SpectraBase Compound ID | 6ov3TjvzVGk |
|---|---|
| InChI | InChI=1S/C16H17ClN2O/c17-12-7-13-18-16(20)19(14-8-3-1-4-9-14)15-10-5-2-6-11-15/h1-6,8-11H,7,12-13H2,(H,18,20) |
| InChIKey | NJCHUJPOJPXMCS-UHFFFAOYSA-N |
| Mol Weight | 288.78 g/mol |
| Molecular Formula | C16H17ClN2O |
| Exact Mass | 288.102941 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 5pQASmPk4TA |
|---|---|
| Name | 3-(3-Chloropropyl)-1,1-diphenylurea |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 288.102940874 u |
| Formula | C16H17ClN2O |
| InChI | InChI=1S/C16H17ClN2O/c17-12-7-13-18-16(20)19(14-8-3-1-4-9-14)15-10-5-2-6-11-15/h1-6,8-11H,7,12-13H2,(H,18,20) |
| InChIKey | NJCHUJPOJPXMCS-UHFFFAOYSA-N |
| Molecular Weight | 288.778 g/mol |
| SMILES | N(C(N(C1=CC=CC=C1)C=1C=CC=CC1)=O)CCCCl |