![N-Butyl-1-phenyl-1H-pyrazolo[3,4-D]pyrimidin-4-amine](/api/spectrum/JSMODfVY3il/structure.png?h=300&w=458 "N-Butyl-1-phenyl-1H-pyrazolo[3,4-D]pyrimidin-4-amine")
| SpectraBase Compound ID | 4hXDWM73gcV |
|---|---|
| InChI | InChI=1S/C15H17N5/c1-2-3-9-16-14-13-10-19-20(15(13)18-11-17-14)12-7-5-4-6-8-12/h4-8,10-11H,2-3,9H2,1H3,(H,16,17,18) |
| InChIKey | GINHYDUSSMVIEH-UHFFFAOYSA-N |
| Mol Weight | 267.34 g/mol |
| Molecular Formula | C15H17N5 |
| Exact Mass | 267.148396 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JSMODfVY3il |
|---|---|
| Name | N-Butyl-1-phenyl-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 | 267.148395567 u |
| Formula | C15H17N5 |
| InChI | InChI=1S/C15H17N5/c1-2-3-9-16-14-13-10-19-20(15(13)18-11-17-14)12-7-5-4-6-8-12/h4-8,10-11H,2-3,9H2,1H3,(H,16,17,18) |
| InChIKey | GINHYDUSSMVIEH-UHFFFAOYSA-N |
| Molecular Weight | 267.336 g/mol |
| SMILES | C1=NN(C=2C1=C(N=CN2)NCCCC)C1=CC=CC=C1 |