| SpectraBase Compound ID | DHBbcfRIYg |
|---|---|
| InChI | InChI=1S/C17H20N2O/c1-13-5-9-15(10-6-13)18-17(19(3)4)20-16-11-7-14(2)8-12-16/h5-12H,1-4H3/b18-17+ |
| InChIKey | GXXATAHTGINMCI-ISLYRVAYSA-N |
| Mol Weight | 268.36 g/mol |
| Molecular Formula | C17H20N2O |
| Exact Mass | 268.157563 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5J9UjQqDYwM |
|---|---|
| Name | 1,1-Dimethyl-2,3-di(p-tolyl)isourea |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 268.157563271 u |
| Formula | C17H20N2O |
| InChI | InChI=1S/C17H20N2O/c1-13-5-9-15(10-6-13)18-17(19(3)4)20-16-11-7-14(2)8-12-16/h5-12H,1-4H3/b18-17+ |
| InChIKey | GXXATAHTGINMCI-ISLYRVAYSA-N |
| Molecular Weight | 268.360 g/mol |
| SMILES | C1(=CC=C(C=C1)O\C(=N\C1=CC=C(C=C1)C)N(C)C)C |