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5-(2-Hydroxy-2,4-dimethylphenyl)[1,2,4]triazolo[4,3-a]pyrimidine
SpectraBase Compound ID LE5XuB7JGTg
InChI InChI=1S/C13H12N4O/c1-8-5-9(2)12(18)10(6-8)11-3-4-14-13-16-15-7-17(11)13/h3-7,18H,1-2H3
InChIKey LFIXOUCTIKDHBX-UHFFFAOYSA-N
Mol Weight 240.27 g/mol
Molecular Formula C13H12N4O
Exact Mass 240.101111 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IdlGoAsgCGB
Name 5-(2-Hydroxy-2,4-dimethylphenyl)[1,2,4]triazolo[4,3-a]pyrimidine
Appearance Yellow crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H12N4O
InChI InChI=1S/C13H12N4O/c1-8-5-9(2)12(18)10(6-8)11-3-4-14-13-16-15-7-17(11)13/h3-7,18H,1-2H3
InChIKey LFIXOUCTIKDHBX-UHFFFAOYSA-N
Instrument Name Shimadzu 2010
Ionization Type EI
Literature Reference DOI 10.1002/jhet.3975
Molecular Weight 240.266 g/mol
SMILES Oc1c(cc(cc1C)C)C1=CC=Nc2[n]1cnn2
SPLASH splash10-074l-5930000000-bbf5e0a4d2d01a986c8d
Source of Spectrum Y-57-2582-16
Wiley ID 1860199