| SpectraBase Compound ID | GIRAo6MYRcp |
|---|---|
| InChI | InChI=1S/C11H15ClN2O/c1-9-3-5-10(6-4-9)14-11(15)13-8-2-7-12/h3-6H,2,7-8H2,1H3,(H2,13,14,15) |
| InChIKey | KPHXVRYLWHOELR-UHFFFAOYSA-N |
| Mol Weight | 226.71 g/mol |
| Molecular Formula | C11H15ClN2O |
| Exact Mass | 226.087291 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Gcdcb7088gZ |
|---|---|
| Name | 1-(3-Chloropropyl)-3-p-tolylurea |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 226.087290810 u |
| Formula | C11H15ClN2O |
| InChI | InChI=1S/C11H15ClN2O/c1-9-3-5-10(6-4-9)14-11(15)13-8-2-7-12/h3-6H,2,7-8H2,1H3,(H2,13,14,15) |
| InChIKey | KPHXVRYLWHOELR-UHFFFAOYSA-N |
| Molecular Weight | 226.707 g/mol |
| SMILES | N(C1=CC=C(C=C1)C)C(NCCCCl)=O |