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2-(p-Tolyl)-2H-benzo[4,5]imidazo[1,2-a][1,2,3]triazolo[4,5-e]pyrimidine
SpectraBase Compound ID EqKdvO1ycCF
InChI InChI=1S/C17H12N6/c1-11-6-8-12(9-7-11)23-20-14-10-18-17-19-13-4-2-3-5-15(13)22(17)16(14)21-23/h2-10H,1H3
InChIKey APLNPPZFLOXMDQ-UHFFFAOYSA-N
Mol Weight 300.33 g/mol
Molecular Formula C17H12N6
Exact Mass 300.112344 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7LclRDsee2
Name 2-(p-Tolyl)-2H-benzo[4,5]imidazo[1,2-a][1,2,3]triazolo[4,5-e]pyrimidine
Appearance Yellow powder
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H12N6
InChI InChI=1S/C17H12N6/c1-11-6-8-12(9-7-11)23-20-14-10-18-17-19-13-4-2-3-5-15(13)22(17)16(14)21-23/h2-10H,1H3
InChIKey APLNPPZFLOXMDQ-UHFFFAOYSA-N
Instrument Name Shimadzu GCMS-QP 2010 Ultra
Ionization Type EI
Literature Reference DOI 10.1021/acs.joc.1c00760
Molecular Weight 300.325 g/mol
SMILES c1(-[n]2nc-3c(C=Nc4[n]3c3c(n4)cccc3)n2)ccc(cc1)C
SPLASH splash10-0udi-9408000000-cd82afb19cd4173dc18c
Source of Spectrum JOC-86-SM35-8b
Thin-Layer Chromatography Rf = 0.4 (CHCl3)
Wiley ID 1867786