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4-(4-Methylphenyl)-4H-1,2,4-triazole

View entire compound with spectra: 1 MS (GC)

4-(4-Methylphenyl)-4H-1,2,4-triazole
SpectraBase Compound ID 1DuMKWqNHHW
InChI InChI=1S/C9H9N3/c1-8-2-4-9(5-3-8)12-6-10-11-7-12/h2-7H,1H3
InChIKey TTWGNOOILHAXQA-UHFFFAOYSA-N
Mol Weight 159.19 g/mol
Molecular Formula C9H9N3
Exact Mass 159.079647 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID btHfEycpo8
Name 4-(4-Methylphenyl)-4H-1,2,4-triazole
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H9N3
InChI InChI=1S/C9H9N3/c1-8-2-4-9(5-3-8)12-6-10-11-7-12/h2-7H,1H3
InChIKey TTWGNOOILHAXQA-UHFFFAOYSA-N
Molecular Weight 159.192 g/mol
SMILES c1[n](cnn1)-c1ccc(cc1)C
SPLASH splash10-0a4i-0900000000-ce4212258a2ec9b46b80
Source of Spectrum F4-42-2280-2a
Synonyms 4-(4-methylphenyl)-1,2,4-triazole
Wiley ID 1674171