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4-Amino-5-methyl-5-phenyl-1,2,4-triazole-3-thione

View entire compound with spectra: 1 MS (GC)

4-Amino-5-methyl-5-phenyl-1,2,4-triazole-3-thione
SpectraBase Compound ID IrbA6tlWSsW
InChI InChI=1S/C9H12N4S/c1-9(7-5-3-2-4-6-7)12-11-8(14)13(9)10/h2-6,12H,10H2,1H3,(H,11,14)
InChIKey NZSYNRPPLLCCHC-UHFFFAOYSA-N
Mol Weight 208.28 g/mol
Molecular Formula C9H12N4S
Exact Mass 208.078268 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3oJldnZLou
Name 4-Amino-5-methyl-5-phenyl-1,2,4-triazole-3-thione
Alternate Name(s) 4-Amino-5-methyl-5-phenyl-1,2,4-triazolidine-3-thione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H12N4S
InChI InChI=1S/C9H12N4S/c1-9(7-5-3-2-4-6-7)12-11-8(14)13(9)10/h2-6,12H,10H2,1H3,(H,11,14)
InChIKey NZSYNRPPLLCCHC-UHFFFAOYSA-N
Molecular Weight 208.283 g/mol
SMILES N1NC(N(C1(c1ccccc1)C)N)=S
SPLASH splash10-0kdi-7940000000-802de9506a513a5c2ca3
Source of Spectrum O1-29-498-36
Wiley ID 818391