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3-tert-Butyl-1,5-diphenyl-6-thioxoverdazyl
SpectraBase Compound ID FxzkB89w69i
InChI InChI=1S/C18H19N4S/c1-18(2,3)16-19-21(14-10-6-4-7-11-14)17(23)22(20-16)15-12-8-5-9-13-15/h4-13H,1-3H3
InChIKey XNHWEJQQZOWVQM-UHFFFAOYSA-N
Mol Weight 324.45 g/mol
Molecular Formula C18H20N4S
Exact Mass 324.140868 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DpCPQWwcUvF
Name 3-tert-Butyl-1,5-diphenyl-6-thioxoverdazyl
Alternate Name(s) 6-tert-Butyl-2,4-diphenyl-1,2,4,5-tetrazine-3-thione 6-tert-Butyl-2,4-diphenyl-3-sulfanylidene-1,2,3,4-tetrahydro-1,2,4,5-tetrazin-1-yl
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Formula C18H19N4S
InChI InChI=1S/C18H19N4S/c1-18(2,3)16-19-21(14-10-6-4-7-11-14)17(23)22(20-16)15-12-8-5-9-13-15/h4-13H,1-3H3
InChIKey XNHWEJQQZOWVQM-UHFFFAOYSA-N
Molecular Weight 324.446 g/mol
SMILES N1N(C(N(N=C1C(C)(C)C)c1ccccc1)=S)c1ccccc1
SPLASH splash10-004i-9104000000-0d56fe7c9f11f94a1d6a
Source of Spectrum KC-0-544-3
Wiley ID 821176