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6-amino-4-(4-chlorophenyl)-3-methyl-1H-pyrazolo[3,4-b]pyridin-5-carbonitrile
SpectraBase Compound ID HBRANPitzqp
InChI InChI=1S/C14H10ClN5/c1-7-11-12(8-2-4-9(15)5-3-8)10(6-16)13(17)18-14(11)20-19-7/h2-5H,1H3,(H3,17,18,19,20)
InChIKey NBLJSHVOFCYBPE-UHFFFAOYSA-N
Mol Weight 283.72 g/mol
Molecular Formula C14H10ClN5
Exact Mass 283.062473 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F1AEIoEvnaT
Name 6-amino-4-(4-chlorophenyl)-3-methyl-1H-pyrazolo[3,4-b]pyridin-5-carbonitrile
Appearance Pale brown crystals
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Exact Mass 283.062473042 u
Formula C14H10ClN5
InChI InChI=1S/C14H10ClN5/c1-7-11-12(8-2-4-9(15)5-3-8)10(6-16)13(17)18-14(11)20-19-7/h2-5H,1H3,(H3,17,18,19,20)
InChIKey NBLJSHVOFCYBPE-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/jhet.4423
Quality 240
SMILES N1N=C(C2=C(C(=C(N=C12)N)C#N)C1=CC=C(C=C1)Cl)C
SPLASH splash10-01t9-7900000000-060cb58885e691425ebc
Source of Spectrum Y-59-844-10b (DOI: 10.1002/jhet.4423)
Wiley ID 1892455