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3-((4-Chlorophenyl)diazenyl)benzo[4,5]imidazo[1,2-a]pyrimidin-4-amine
SpectraBase Compound ID B1GK4eRinlg
InChI InChI=1S/C16H11ClN6/c17-10-5-7-11(8-6-10)21-22-13-9-19-16-20-12-3-1-2-4-14(12)23(16)15(13)18/h1-9H,18H2
InChIKey WOVPMUBNRMSDBI-UHFFFAOYSA-N
Mol Weight 322.76 g/mol
Molecular Formula C16H11ClN6
Exact Mass 322.073372 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AGGhZqUAApc
Name 3-((4-Chlorophenyl)diazenyl)benzo[4,5]imidazo[1,2-a]pyrimidin-4-amine
Appearance Orange powder
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H11ClN6
InChI InChI=1S/C16H11ClN6/c17-10-5-7-11(8-6-10)21-22-13-9-19-16-20-12-3-1-2-4-14(12)23(16)15(13)18/h1-9H,18H2
InChIKey WOVPMUBNRMSDBI-UHFFFAOYSA-N
Instrument Name Shimadzu GCMS-QP 2010 Ultra
Ionization Type EI
Literature Reference DOI 10.1021/acs.joc.1c00760
Molecular Weight 322.759 g/mol
SMILES NC=1[n]2c(N=CC1N=Nc1ccc(cc1)Cl)nc1c2cccc1
SPLASH splash10-0230-4913000000-fa17e3ddb370ef6fe1b8
Source of Spectrum JOC-86-SM19-6d
Wiley ID 1867778