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4-Amino-5-(chloro-difluoro-methyl)-4H-[1,2,4]triazole-3-thiol
SpectraBase Compound ID Cfvj1nWJ3hg
InChI InChI=1S/C3H3ClF2N4S/c4-3(5,6)1-8-9-2(11)10(1)7/h7H2,(H,9,11)
InChIKey ROHVAOYJHGAGSU-UHFFFAOYSA-N
Mol Weight 200.59 g/mol
Molecular Formula C3H3ClF2N4S
Exact Mass 199.973501 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9i3yVA4dpsh
Name 4-Amino-5-(chloro-difluoro-methyl)-4H-[1,2,4]triazole-3-thiol
Alternate Name(s) 4-Amino-3-[chloro(difluoro)methyl]-1H-1,2,4-triazole-5-thione 4-Azanyl-3-[chloranyl-bis(fluoranyl)methyl]-1H-1,2,4-triazole-5-thione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C3H3ClF2N4S
InChI InChI=1S/C3H3ClF2N4S/c4-3(5,6)1-8-9-2(11)10(1)7/h7H2,(H,9,11)
InChIKey ROHVAOYJHGAGSU-UHFFFAOYSA-N
Molecular Weight 200.595 g/mol
SMILES N[n]1c(nnc1S)C(Cl)(F)F
SPLASH splash10-0udi-9230000000-08a4c4fd0501bc2233d2
Wiley ID 1451228