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5-phenyl-2H-benzo[4,5]imidazo[1,2-c]pyrazolo[4,3-e]pyrimidin-1-amine
SpectraBase Compound ID JnJaYMBq7cN
InChI InChI=1S/C17H12N6/c18-14-13-15(22-21-14)20-16(10-6-2-1-3-7-10)23-12-9-5-4-8-11(12)19-17(13)23/h1-9H,(H3,18,21,22)
InChIKey HXKPGMVLOOLRAE-UHFFFAOYSA-N
Mol Weight 300.32 g/mol
Molecular Formula C17H12N6
Exact Mass 300.112344 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID hbeMDafrM
Name 5-phenyl-2H-benzo[4,5]imidazo[1,2-c]pyrazolo[4,3-e]pyrimidin-1-amine
Appearance Black solid
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H12N6
InChI InChI=1S/C17H12N6/c18-14-13-15(22-21-14)20-16(10-6-2-1-3-7-10)23-12-9-5-4-8-11(12)19-17(13)23/h1-9H,(H3,18,21,22)
InChIKey HXKPGMVLOOLRAE-UHFFFAOYSA-N
Instrument Name Schimadzu QP-5050A
Ionization Type EI
Literature Reference DOI 10.1002/jhet.3979
Molecular Weight 300.325 g/mol
SMILES [nH]1c(c2-c3[n](C(=Nc2n1)c1ccccc1)c1c(n3)cccc1)N
SPLASH splash10-0l90-6900000000-80603d17cadfee3e5b05
Source of Spectrum Y-57-SM37-19
Wiley ID 1860215