CID 78450

4723-99-3

Structural Information

Molecular Formula
C6H12As2S6
SMILES
C1CS[As](S1)SCCS[As]2SCCS2
InChI
InChI=1S/C6H12As2S6/c1-2-10-7(9-1)13-5-6-14-8-11-3-4-12-8/h1-6H2
InChIKey
APFDJSPXLKMXBQ-UHFFFAOYSA-N
Compound name
2-[2-(1,3,2-dithiarsolan-2-ylsulfanyl)ethylsulfanyl]-1,3,2-dithiarsolane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

425.76953 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 426.77681 196.1
[M+Na]+ 448.75875 203.1
[M-H]- 424.76225 195.7
[M+NH4]+ 443.80335 210.7
[M+K]+ 464.73269 191.6
[M+H-H2O]+ 408.76679 191.1
[M+HCOO]- 470.76773 184.6
[M+CH3COO]- 484.78338 200.1
[M+Na-2H]- 446.74420 191.7
[M]+ 425.76898 185.0
[M]- 425.77008 185.0
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

No patent data available for this compound.