| SpectraBase Compound ID | AjPRYzIblrG |
|---|---|
| InChI | InChI=1S/C14H15N5/c1-8-4-6-11(7-5-8)19-14-12-13(16-9(2)15-12)17-10(3)18-14/h4-7H,1-3H3,(H2,15,16,17,18,19) |
| InChIKey | UDQBQIAGJDCDDS-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 | 3neYJ0TKXwi |
|---|---|
| Name | 6-(4-Methylphenyl)amino-2,8-dimethyl-9H-purine |
| 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/c1-8-4-6-11(7-5-8)19-14-12-13(16-9(2)15-12)17-10(3)18-14/h4-7H,1-3H3,(H2,15,16,17,18,19) |
| InChIKey | UDQBQIAGJDCDDS-UHFFFAOYSA-N |
| Molecular Weight | 253.309 g/mol |
| SMILES | C1(=NC2=C(N=C(N=C2N1)C)NC=1C=CC(=CC1)C)C |