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4-ethyl-5-isopropyl-4H-1,2,4-triazol-3-yl hydrosulfide
SpectraBase Compound ID 2fiCTTdrNXF
InChI InChI=1S/C7H13N3S/c1-4-10-6(5(2)3)8-9-7(10)11/h5H,4H2,1-3H3,(H,9,11)
InChIKey COUIQWQZEOIERG-UHFFFAOYSA-N
Mol Weight 171.26 g/mol
Molecular Formula C7H13N3S
Exact Mass 171.083019 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C13uMwkuZtr
Name 4-Ethyl-5-isopropyl-4H-1,2,4-triazol-3-yl hydrosulfide
CAS Registry Number 66921-11-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H13N3S
InChI InChI=1S/C7H13N3S/c1-4-10-6(5(2)3)8-9-7(10)11/h5H,4H2,1-3H3,(H,9,11)
InChIKey COUIQWQZEOIERG-UHFFFAOYSA-N
Molecular Weight 171.262 g/mol
SMILES Sc1nnc(C(C)C)[n]1CC
SPLASH splash10-05bf-9700000000-edd30f3061ce02cb0e95
Source of Spectrum Y-15-238-0
Synonyms 3-Mercapto-4-ethyl-5-isopropyl-1,2,4-triazole 4-Ethyl-3-isopropyl-1H-1,2,4-triazole-5-thione 4-Ethyl-3-propan-2-yl-1H-1,2,4-triazole-5-thione 4-Ethyl-5-isopropyl-4H-1,2,4-triazole-3-thiol
Wiley ID 1167822