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3-isoamyl-4-methyl-1H-1,2,4-triazole-5-thione
SpectraBase Compound ID 1zYx4H3fFfx
InChI InChI=1S/C8H15N3S/c1-6(2)4-5-7-9-10-8(12)11(7)3/h6H,4-5H2,1-3H3,(H,10,12)
InChIKey ZHLQFVZQOIAMNW-UHFFFAOYSA-N
Mol Weight 185.29 g/mol
Molecular Formula C8H15N3S
Exact Mass 185.098669 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IhFgPgtSgu1
Name 3-isoamyl-4-methyl-1H-1,2,4-triazole-5-thione
CAS Registry Number 66921-10-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H15N3S
InChI InChI=1S/C8H15N3S/c1-6(2)4-5-7-9-10-8(12)11(7)3/h6H,4-5H2,1-3H3,(H,10,12)
InChIKey ZHLQFVZQOIAMNW-UHFFFAOYSA-N
Molecular Weight 185.289 g/mol
SMILES N1N=C(N(C1=S)C)CCC(C)C
SPLASH splash10-0570-5900000000-77f9b366633868ab4b0e
Source of Spectrum Y-15-238-0
Synonyms 3-isopentyl-4-methyl-1H-1,2,4-triazole-5-thione 4-Methyl-3-(3-methylbutyl)-1H-1,2,4-triazole-5-thione
Wiley ID 1181783