![Pyrazolo[1,5-a]pyrimidine-2-carboxylic acid, 6-bromo-3-chloro-, (octahydro-2H-quinolizin-1-yl)methyl ester](/api/spectrum/1AQbhQXsJvx/structure.png?h=300&w=458 "Pyrazolo[1,5-a]pyrimidine-2-carboxylic acid, 6-bromo-3-chloro-, (octahydro-2H-quinolizin-1-yl)methyl ester")
| SpectraBase Compound ID | e4GBvc1oYh |
|---|---|
| InChI | InChI=1S/C17H20BrClN4O2/c18-12-8-20-16-14(19)15(21-23(16)9-12)17(24)25-10-11-4-3-7-22-6-2-1-5-13(11)22/h8-9,11,13H,1-7,10H2 |
| InChIKey | UPZBPJXOSSLKCU-UHFFFAOYSA-N |
| Mol Weight | 427.73 g/mol |
| Molecular Formula | C17H20BrClN4O2 |
| Exact Mass | 426.045817 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 1AQbhQXsJvx |
|---|---|
| Name | Pyrazolo[1,5-a]pyrimidine-2-carboxylic acid, 6-bromo-3-chloro-, (octahydro-2H-quinolizin-1-yl)methyl ester |
| Alternate Name(s) | 6-Bromo-3-chloro-2-pyrazolo[1,5-a]pyrimidinecarboxylic acid 2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-ylmethyl ester 2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-ylmethyl 6-bromo-3-chloropyrazolo[1,5-a]pyrimidine-2-carboxylate 2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-ylmethyl 6-bromo-3-chloro-pyrazolo[1,5-a]pyrimidine-2-carboxylate 2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-ylmethyl 6-bromanyl-3-chloranyl-pyrazolo[1,5-a]pyrimidine-2-carboxylate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C17H20BrClN4O2 |
| InChI | InChI=1S/C17H20BrClN4O2/c18-12-8-20-16-14(19)15(21-23(16)9-12)17(24)25-10-11-4-3-7-22-6-2-1-5-13(11)22/h8-9,11,13H,1-7,10H2 |
| InChIKey | UPZBPJXOSSLKCU-UHFFFAOYSA-N |
| Molecular Weight | 427.730 g/mol |
| SMILES | c12[n](nc(c2Cl)C(OCC2C3N(CCC2)CCCC3)=O)C=C(Br)C=N1 |
| SPLASH | splash10-0udi-9700000000-47faac5fccb34fc57dd4 |
| Source of Spectrum | IY-1-4682-7 |
| Wiley ID | 1654810 |