Bis(dimethylthiocarbamyl) sulfide(97-74-5) IR3
Product NameBis(dimethylthiocarbamyl) sulfide
CAS97-74-5
Molecular FormulaC6H12N2S3
Molecular Weight208.37
InChIInChI=1S/C6H12N2S3/c1-7(2)5(9)11-6(10)8(3)4/h1-4H3
InChIKey REQPQFUJGGOFQL-UHFFFAOYSA-N
SmilesC(=S)(SC(=S)N(C)C)N(C)C
-
MassMS-NW-5649 tetramethylthiuram monosulfide C6H12N2S3 (Mass of molecular ion: 208)
Source Temperature: 160 °C Sample Temperature: 120 °C Direct, 75 eV
15.0 3.1 18.0 1.6 28.0 1.7 42.0 7.7 43.0 1.4 44.0 6.9 45.0 1.8 47.0 2.2 56.0 2.5 72.0 2.9 73.0 7.6 74.0 1.0 76.0 1.5 77.0 2.7 88.0 100.0 89.0 5.9 90.0 4.5 120.0 1.7 176.0 1.2 208.0 17.0 209.0 1.8 210.0 2.6
90 MHz in CDCl3
-
1H NMR 89.56 MHz C6 H12 N2 S3 0.047 g : 0.5 ml CDCl3 tetramethylthiuram monosulfide 
Assign. Shift(ppm)
A *1 3.523 B *1 3.440
Hz ppm Int.324.31 3.622 30 322.88 3.606 32 322.56 3.602 34 322.13 3.597 38 321.38 3.589 44 320.81 3.583 49 320.38 3.578 52 315.56 3.524 986 308.13 3.441 1000 301.75 3.370 40
in CDCl3
CCl4 solution
KBr disc
nujol mull
