![N-(2,4-dimethylphenyl)-1-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-amine](/api/spectrum/1bx14M630M7/structure.png?h=300&w=458 "N-(2,4-dimethylphenyl)-1-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-amine")
| SpectraBase Compound ID | 3tLIkn1XBic |
|---|---|
| InChI | InChI=1S/C14H15N5/c1-9-4-5-12(10(2)6-9)18-13-11-7-17-19(3)14(11)16-8-15-13/h4-8H,1-3H3,(H,15,16,18) |
| InChIKey | MLFYHTPQBJNHKT-UHFFFAOYSA-N |
| Mol Weight | 253.31 g/mol |
| Molecular Formula | C14H15N5 |
| Exact Mass | 253.132746 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1bx14M630M7 |
|---|---|
| Name | N-(2,4-Dimethylphenyl)-1-methyl-1H-pyrazolo[3,4-D]pyrimidin-4-amine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 253.132745503 u |
| Formula | C14H15N5 |
| InChI | InChI=1S/C14H15N5/c1-9-4-5-12(10(2)6-9)18-13-11-7-17-19(3)14(11)16-8-15-13/h4-8H,1-3H3,(H,15,16,18) |
| InChIKey | MLFYHTPQBJNHKT-UHFFFAOYSA-N |
| Molecular Weight | 253.309 g/mol |
| SMILES | C1=NN(C=2C1=C(N=CN2)NC1=C(C=C(C=C1)C)C)C |