CID 66810

Tetramethylthiuram tetrasulfide

Structural Information

Molecular Formula
C6H12N2S6
SMILES
CN(C)C(=S)SSSSC(=S)N(C)C
InChI
InChI=1S/C6H12N2S6/c1-7(2)5(9)11-13-14-12-6(10)8(3)4/h1-4H3
InChIKey
VHSBTBDMKDUVKG-UHFFFAOYSA-N
Compound name
(dimethylcarbamothioyltrisulfanyl) N,N-dimethylcarbamodithioate
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

1102
Patents

303.93246 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 304.93974 177.1
[M+Na]+ 326.92168 179.7
[M-H]- 302.92518 172.7
[M+NH4]+ 321.96628 187.8
[M+K]+ 342.89562 166.5
[M+H-H2O]+ 286.92972 167.6
[M+HCOO]- 348.93066 163.0
[M+CH3COO]- 362.94631 213.5
[M+Na-2H]- 324.90713 175.6
[M]+ 303.93191 166.7
[M]- 303.93301 166.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe