![2-(4-Chlorophenyl)-3,5-dimethylpyrazolo[1,5-a]pyrimidin-7(4H)-one](/api/spectrum/E47wI1B8MBV/structure.png?h=300&w=458 "2-(4-Chlorophenyl)-3,5-dimethylpyrazolo[1,5-a]pyrimidin-7(4H)-one")
| SpectraBase Compound ID | GCi14oGx7az |
|---|---|
| InChI | InChI=1S/C14H12ClN3O/c1-8-7-12(19)18-14(16-8)9(2)13(17-18)10-3-5-11(15)6-4-10/h3-7,16H,1-2H3 |
| InChIKey | HNOZXAPLIZUHTF-UHFFFAOYSA-N |
| Mol Weight | 273.72 g/mol |
| Molecular Formula | C14H12ClN3O |
| Exact Mass | 273.06689 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | E47wI1B8MBV |
|---|---|
| Name | 2-(4-Chlorophenyl)-3,5-dimethylpyrazolo[1,5-A]pyrimidin-7(4H)-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 273.066889717 u |
| Formula | C14H12ClN3O |
| InChI | InChI=1S/C14H12ClN3O/c1-8-7-12(19)18-14(16-8)9(2)13(17-18)10-3-5-11(15)6-4-10/h3-7,16H,1-2H3 |
| InChIKey | HNOZXAPLIZUHTF-UHFFFAOYSA-N |
| SMILES | C1=2N(N=C(C2C)C=2C=CC(=CC2)Cl)C(C=C(N1)C)=O |