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4-Amino-5-isobutyl-5-methyl-1,2,4-triazole-3-thione
SpectraBase Compound ID 4Gjjwxq9pMe
InChI InChI=1S/C7H16N4S/c1-5(2)4-7(3)10-9-6(12)11(7)8/h5,10H,4,8H2,1-3H3,(H,9,12)
InChIKey LUWXUNXSBDIYDX-UHFFFAOYSA-N
Mol Weight 188.29 g/mol
Molecular Formula C7H16N4S
Exact Mass 188.109568 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AKlwZ3Mc38m
Name 4-Amino-5-isobutyl-5-methyl-1,2,4-triazole-3-thione
Alternate Name(s) 4-Amino-5-isobutyl-5-methyl-1,2,4-triazolidine-3-thione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H16N4S
InChI InChI=1S/C7H16N4S/c1-5(2)4-7(3)10-9-6(12)11(7)8/h5,10H,4,8H2,1-3H3,(H,9,12)
InChIKey LUWXUNXSBDIYDX-UHFFFAOYSA-N
Molecular Weight 188.293 g/mol
SMILES N1NC(N(C1(CC(C)C)C)N)=S
SPLASH splash10-0a4u-8900000000-b562a2336e4c5310308b
Source of Spectrum O1-29-498-32
Wiley ID 818395