CID 230911

Nsc26331

Structural Information

Molecular Formula
C2S6
SMILES
C1(=S)SSC(=S)SS1
InChI
InChI=1S/C2S6/c3-1-5-7-2(4)8-6-1
InChIKey
DBRDVGHMKWLZMJ-UHFFFAOYSA-N
Compound name
1,2,4,5-tetrathiane-3,6-dithione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

215.83243 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 216.83971 157.8
[M+Na]+ 238.82165 164.5
[M-H]- 214.82515 155.0
[M+NH4]+ 233.86625 171.6
[M+K]+ 254.79559 150.7
[M+H-H2O]+ 198.82969 151.7
[M+HCOO]- 260.83063 144.8
[M+CH3COO]- 274.84628 162.8
[M+Na-2H]- 236.80710 157.1
[M]+ 215.83188 143.0
[M]- 215.83298 143.0
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.