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3-Benzyl-5-methyl-1H-1,2,4-triazole

View entire compound with spectra: 1 MS (GC)

3-Benzyl-5-methyl-1H-1,2,4-triazole
SpectraBase Compound ID AvZfbLi4cWr
InChI InChI=1S/C10H11N3/c1-8-11-10(13-12-8)7-9-5-3-2-4-6-9/h2-6H,7H2,1H3,(H,11,12,13)
InChIKey UNNZAVKDDQJDRP-UHFFFAOYSA-N
Mol Weight 173.22 g/mol
Molecular Formula C10H11N3
Exact Mass 173.095297 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JMOa7B3FTsA
Name 3-Benzyl-5-methyl-1H-1,2,4-triazole
Alternate Name(s) 3-Benzyl-5-methyl-4H-1,2,4-triazole 5-Methyl-3-(phenylmethyl)-1H-1,2,4-triazole
CAS Registry Number 16194-97-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H11N3
InChI InChI=1S/C10H11N3/c1-8-11-10(13-12-8)7-9-5-3-2-4-6-9/h2-6H,7H2,1H3,(H,11,12,13)
InChIKey UNNZAVKDDQJDRP-UHFFFAOYSA-N
Molecular Weight 173.219 g/mol
SMILES [nH]1nc(nc1C)Cc1ccccc1
SPLASH splash10-00di-7900000000-0aebf14355f244c23a88
Source of Spectrum W5-1989-36407-29129
Wiley ID 1169816