![2,4-Pyrimidinediamine, 6-chloro-N4-[(2-chlorophenyl)methyl]-](/api/spectrum/9GbPJ2uSGsa/structure.png?h=300&w=458 "2,4-Pyrimidinediamine, 6-chloro-N4-[(2-chlorophenyl)methyl]-")
| SpectraBase Compound ID | 9nnoEQd0UAR |
|---|---|
| InChI | InChI=1S/C11H10Cl2N4/c12-8-4-2-1-3-7(8)6-15-10-5-9(13)16-11(14)17-10/h1-5H,6H2,(H3,14,15,16,17) |
| InChIKey | SWCLLCYSACRMOP-UHFFFAOYSA-N |
| Mol Weight | 269.13 g/mol |
| Molecular Formula | C11H10Cl2N4 |
| Exact Mass | 268.028252 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 | 9GbPJ2uSGsa |
|---|---|
| Name | 2,4-Pyrimidinediamine, 6-chloro-N4-[(2-chlorophenyl)methyl]- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 268.028251738 u |
| Formula | C11H10Cl2N4 |
| InChI | InChI=1S/C11H10Cl2N4/c12-8-4-2-1-3-7(8)6-15-10-5-9(13)16-11(14)17-10/h1-5H,6H2,(H3,14,15,16,17) |
| InChIKey | SWCLLCYSACRMOP-UHFFFAOYSA-N |
| SMILES | NC1=NC(=CC(=N1)NCC1=C(C=CC=C1)Cl)Cl |