CID 95248

3670-93-7

Structural Information

Molecular Formula
C5H8O6S2
SMILES
C1C2(COS(=O)O1)COS(=O)OC2
InChI
InChI=1S/C5H8O6S2/c6-12-8-1-5(2-9-12)3-10-13(7)11-4-5/h1-4H2
InChIKey
UCFQFMBCPHTKRN-UHFFFAOYSA-N
Compound name
2,4,8,10-tetraoxa-3lambda4,9lambda4-dithiaspiro[5.5]undecane 3,9-dioxide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

227.97623 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 228.98351 141.0
[M+Na]+ 250.96545 150.7
[M+NH4]+ 246.01005 150.0
[M+K]+ 266.93939 143.2
[M-H]- 226.96895 147.3
[M+Na-2H]- 248.95090 143.9
[M]+ 227.97568 145.1
[M]- 227.97678 145.1
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

patents stripe