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methyl 3,5-di(t-butyl)-biphenyl-2-dithiocarboxylate
SpectraBase Compound ID BbLLOVHVobz
InChI InChI=1S/C22H28S2/c1-21(2,3)16-13-17(15-11-9-8-10-12-15)19(20(23)24-7)18(14-16)22(4,5)6/h8-14H,1-7H3
InChIKey DRERXEAKAUMQHJ-UHFFFAOYSA-N
Mol Weight 356.59 g/mol
Molecular Formula C22H28S2
Exact Mass 356.163243 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HTap4EMtA6R
Name methyl 3,5-di(t-butyl)-biphenyl-2-dithiocarboxylate
Alternate Name(s) methyl 3,5-ditert-butyl[1,1'-biphenyl]-2-carbodithioate
CAS Registry Number 119337-38-1
Comments Less than 3 mono-isotopic peaks
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Formula C22H28S2
InChI InChI=1S/C22H28S2/c1-21(2,3)16-13-17(15-11-9-8-10-12-15)19(20(23)24-7)18(14-16)22(4,5)6/h8-14H,1-7H3
InChIKey DRERXEAKAUMQHJ-UHFFFAOYSA-N
Molecular Weight 356.586 g/mol
SMILES c1(c(c(-c2ccccc2)cc(c1)C(C)(C)C)C(=S)SC)C(C)(C)C
SPLASH splash10-0a4i-0009000000-be1869efdca1ab66e3c5
Source of Spectrum K-122-1011-2
Wiley ID 1346078