| SpectraBase Compound ID | 4XKBFnyc1yR |
|---|---|
| InChI | InChI=1S/C11H9Cl2N3O2/c1-6-4-10(16-18-6)15-11(17)14-7-2-3-8(12)9(13)5-7/h2-5H,1H3,(H2,14,15,16,17) |
| InChIKey | JZYMICAMXHNNBK-UHFFFAOYSA-N |
| Mol Weight | 286.12 g/mol |
| Molecular Formula | C11H9Cl2N3O2 |
| Exact Mass | 285.007182 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LSGPj1zm246 |
|---|---|
| Name | N-(3,4-Dichlorophenyl)-N'-(5-methyl-3-isoxazolyl)urea |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 285.007181940 u |
| Formula | C11H9Cl2N3O2 |
| InChI | InChI=1S/C11H9Cl2N3O2/c1-6-4-10(16-18-6)15-11(17)14-7-2-3-8(12)9(13)5-7/h2-5H,1H3,(H2,14,15,16,17) |
| InChIKey | JZYMICAMXHNNBK-UHFFFAOYSA-N |
| Molecular Weight | 286.118 g/mol |
| SMILES | N(C(NC=1C=C(Cl)C(=CC1)Cl)=O)C1=NOC(=C1)C |