![1H-pyrazolo[3,4-d]pyrimidin-4-ol, 1-(4-fluorophenyl)-](/api/spectrum/3MOifvcjZN2/structure.png?h=300&w=458 "1H-pyrazolo[3,4-d]pyrimidin-4-ol, 1-(4-fluorophenyl)-")
| SpectraBase Compound ID | CifRrmZqXm1 |
|---|---|
| InChI | InChI=1S/C11H7FN4O/c12-7-1-3-8(4-2-7)16-10-9(5-15-16)11(17)14-6-13-10/h1-6H,(H,13,14,17) |
| InChIKey | BQCBGAAIDUOCJL-UHFFFAOYSA-N |
| Mol Weight | 230.2 g/mol |
| Molecular Formula | C11H7FN4O |
| Exact Mass | 230.060389 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3MOifvcjZN2 |
|---|---|
| Name | 1H-Pyrazolo[3,4-D]pyrimidin-4-ol, 1-(4-fluorophenyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 230.060389023 u |
| Formula | C11H7FN4O |
| InChI | InChI=1S/C11H7FN4O/c12-7-1-3-8(4-2-7)16-10-9(5-15-16)11(17)14-6-13-10/h1-6H,(H,13,14,17) |
| InChIKey | BQCBGAAIDUOCJL-UHFFFAOYSA-N |
| Molecular Weight | 230.202 g/mol |
| SMILES | OC=1C2=C(N(N=C2)C2=CC=C(C=C2)F)N=CN1 |