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3-(4-Methylphenyl)-8H-[1,2,3]triazolo[5,1-a]isoindole
SpectraBase Compound ID BbRy2rRH9wu
InChI InChI=1S/C16H13N3/c1-11-6-8-12(9-7-11)15-16-14-5-3-2-4-13(14)10-19(16)18-17-15/h2-9H,10H2,1H3
InChIKey GEHNBVGYPGKHHT-UHFFFAOYSA-N
Mol Weight 247.3 g/mol
Molecular Formula C16H13N3
Exact Mass 247.110947 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6MtYbsFzBZA
Name 3-(4-Methylphenyl)-8H-[1,2,3]triazolo[5,1-a]isoindole
Alternate Name(s) 3-(p-tolyl)-8H-[1,2,3]triazolo[5,1-a]isoindole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H13N3
InChI InChI=1S/C16H13N3/c1-11-6-8-12(9-7-11)15-16-14-5-3-2-4-13(14)10-19(16)18-17-15/h2-9H,10H2,1H3
InChIKey GEHNBVGYPGKHHT-UHFFFAOYSA-N
Molecular Weight 247.301 g/mol
SMILES c1-2[n](Cc3ccccc23)nnc1-c1ccc(cc1)C
SPLASH splash10-014j-0090000000-8aed0830348a4cce7eb6
Source of Spectrum JCR-39-189-2f
Wiley ID 1804142