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3-Methyl-2-(4-nitrophenyl)-4-(7-phenylpyrazolo[5,1-c][1,2,4]triazin-3-yl)-2H-pyrazolo[3,4-d]pyridazin-7(6H)-one
SpectraBase Compound ID AXuIz2LHWp1
InChI InChI=1S/C23H15N9O3/c1-13-20-21(18-12-30-19(25-24-18)11-17(28-30)14-5-3-2-4-6-14)26-27-23(33)22(20)29-31(13)15-7-9-16(10-8-15)32(34)35/h2-12H,1H3,(H,27,33)
InChIKey CLEOZKOONITRHZ-UHFFFAOYSA-N
Mol Weight 465.43 g/mol
Molecular Formula C23H15N9O3
Exact Mass 465.129785 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Hv62z3rEwme
Name 3-Methyl-2-(4-nitrophenyl)-4-(7-phenylpyrazolo[5,1-c][1,2,4]triazin-3-yl)-2H-pyrazolo[3,4-d]pyridazin-7(6H)-one
Appearance Yellow solid
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H15N9O3
InChI InChI=1S/C23H15N9O3/c1-13-20-21(18-12-30-19(25-24-18)11-17(28-30)14-5-3-2-4-6-14)26-27-23(33)22(20)29-31(13)15-7-9-16(10-8-15)32(34)35/h2-12H,1H3,(H,27,33)
InChIKey CLEOZKOONITRHZ-UHFFFAOYSA-N
Instrument Name GC??MS QP1000 EX Shimadzu
Ionization Type EI
Literature Reference DOI 10.1002/jhet.3415
Molecular Weight 465.433 g/mol
SMILES N1C(c2c(C(=N1)C=1N=Nc3[n](C1)nc(c3)-c1ccccc1)c([n](n2)-c1ccc(cc1)[N+]([O-])=O)C)=O
SPLASH splash10-03di-9031100000-1a505a225841d9962568
Source of Spectrum Y-56-432-11e
Wiley ID 1859363