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2-tert-Butyl-5-[(4-chlorophenyl)methyl]-N-cyclooctyl-6-methyl-4-oxo-4H,5H,6H,7H-pyrazolo[1,5-a]pyrazine-6-carboxamide
SpectraBase Compound ID 56JzHZutWH5
InChI InChI=1S/C27H37ClN4O2/c1-26(2,3)23-16-22-24(33)31(17-19-12-14-20(28)15-13-19)27(4,18-32(22)30-23)25(34)29-21-10-8-6-5-7-9-11-21/h12-16,21H,5-11,17-18H2,1-4H3,(H,29,34)
InChIKey WRINQZAMPKRHBF-UHFFFAOYSA-N
Mol Weight 485.1 g/mol
Molecular Formula C27H37ClN4O2
Exact Mass 484.260504 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1FVx7bAaAFx
Name 2-tert-Butyl-5-[(4-chlorophenyl)methyl]-N-cyclooctyl-6-methyl-4-oxo-4H,5H,6H,7H-pyrazolo[1,5-a]pyrazine-6-carboxamide
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Formula C27H37ClN4O2
InChI InChI=1S/C27H37ClN4O2/c1-26(2,3)23-16-22-24(33)31(17-19-12-14-20(28)15-13-19)27(4,18-32(22)30-23)25(34)29-21-10-8-6-5-7-9-11-21/h12-16,21H,5-11,17-18H2,1-4H3,(H,29,34)
InChIKey WRINQZAMPKRHBF-UHFFFAOYSA-N
Molecular Weight 485.072 g/mol
SMILES N(C(C1(N(C(c2[n](nc(c2)C(C)(C)C)C1)=O)Cc1ccc(cc1)Cl)C)=O)C1CCCCCCC1
SPLASH splash10-004i-6905000000-ec73c58bfde36af94ff4
Source of Spectrum IY-2-5038-6
Synonyms Pyrazolo[1,5-a]pyrazine-6-carboxamide, 5-[(4-chlorophenyl)methyl]-N-cyclooctyl-2-(1,1-dimethylethyl)-4,5,6,7-tetrahydro-6-methyl-4-oxo- 2-tert-Butyl-5-[(4-chlorophenyl)methyl]-N-cyclooctyl-6-methyl-4-oxo-7H-pyrazolo[1,5-a]pyrazine-6-carboxamide 2-tert-Butyl-5-[(4-chlorophenyl)methyl]-N-cyclooctyl-6-methyl-4-oxidanylidene-7H-pyrazolo[1,5-a]pyrazine-6-carboxamide
Wiley ID 1658369