CID 34447

Bis((4-isopropyl-1-piperazinyl)thiocarbonyl)disulfide

Structural Information

Molecular Formula
C16H30N4S4
SMILES
CC(C)N1CCN(CC1)C(=S)SSC(=S)N2CCN(CC2)C(C)C
InChI
InChI=1S/C16H30N4S4/c1-13(2)17-5-9-19(10-6-17)15(21)23-24-16(22)20-11-7-18(8-12-20)14(3)4/h13-14H,5-12H2,1-4H3
InChIKey
IURSNQOYPYGRJJ-UHFFFAOYSA-N
Compound name
(4-propan-2-ylpiperazine-1-carbothioyl)sulfanyl 4-propan-2-ylpiperazine-1-carbodithioate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

406.13535 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 407.14263 177.7
[M+Na]+ 429.12457 183.4
[M+NH4]+ 424.16917 184.0
[M+K]+ 445.09851 173.3
[M-H]- 405.12807 178.6
[M+Na-2H]- 427.11002 177.8
[M]+ 406.13480 180.2
[M]- 406.13590 180.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.