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6-Chloromethyl-5-methoxycarbonyl-3-methyl-1-phenyl-1H-pyrazolo[3,4-b]pyridine
SpectraBase Compound ID HzOAome6gh3
InChI InChI=1S/C16H14ClN3O2/c1-10-12-8-13(16(21)22-2)14(9-17)18-15(12)20(19-10)11-6-4-3-5-7-11/h3-8H,9H2,1-2H3
InChIKey PEGYJTABHNHVJO-UHFFFAOYSA-N
Mol Weight 315.76 g/mol
Molecular Formula C16H14ClN3O2
Exact Mass 315.077454 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7dqHHwe9P2B
Name 6-Chloromethyl-5-methoxycarbonyl-3-methyl-1-phenyl-1H-pyrazolo[3,4-b]pyridine
Comments Less than 3 mono-isotopic peaks
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Formula C16H14ClN3O2
InChI InChI=1S/C16H14ClN3O2/c1-10-12-8-13(16(21)22-2)14(9-17)18-15(12)20(19-10)11-6-4-3-5-7-11/h3-8H,9H2,1-2H3
InChIKey PEGYJTABHNHVJO-UHFFFAOYSA-N
Molecular Weight 315.760 g/mol
SMILES c12[n](nc(c2cc(c(n1)CCl)C(=O)OC)C)-c1ccccc1
SPLASH splash10-014i-0029000000-474e385891fa47b53392
Source of Spectrum SB-47-325-14
Synonyms methyl 6-(chloromethyl)-3-methyl-1-phenyl-1H-pyrazolo[3,4-b]pyridine-5-carboxylate
Wiley ID 1315909