Di-tert-butyl disulfide(110-06-5) MS
Product NameDi-tert-butyl disulfide
CAS110-06-5
Molecular FormulaC8H18S2
Molecular Weight178.36
InChIInChI=1S/C8H18S2/c1-7(2,3)9-10-8(4,5)6/h1-6H3
InChIKey BKCNDTDWDGQHSD-UHFFFAOYSA-N
SmilesS(C(C)(C)C)SC(C)(C)C
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MassMS-NW-8334 di-tert-butyl disulfide C8H18S2 (Mass of molecular ion: 178)
Source Temperature: 250 °C Sample Temperature: 130 °C Reservoir, 75 eV
27.0 1.9 28.0 1.0 29.0 12.4 39.0 3.1 41.0 18.8 55.0 1.5 56.0 1.1 57.0 100.0 58.0 4.5 59.0 1.2 107.0 1.2 122.0 9.1 178.0 6.7
parameter in CDCl3
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1H NMR 300 MHz C8 H18 S2 0.04 ml : 0.5 ml CDCl3 di-tert-butyl disulfide 
Parameter ppm Hz
D(A) 1.311
Hz ppm Int.393.30 1.311 1000
in CDCl3
CCl4 solution
liquid film
