CID 146082099

[(methanesulfonylsulfanyl)methyl]cyclopropane

Structural Information

Molecular Formula
C5H10O2S2
SMILES
CS(=O)(=O)SCC1CC1
InChI
InChI=1S/C5H10O2S2/c1-9(6,7)8-4-5-2-3-5/h5H,2-4H2,1H3
InChIKey
DXMDTDVDNDWQHH-UHFFFAOYSA-N
Compound name
methylsulfonylsulfanylmethylcyclopropane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

166.01222 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 167.01950 128.0
[M+Na]+ 189.00144 137.5
[M-H]- 165.00494 132.4
[M+NH4]+ 184.04604 144.2
[M+K]+ 204.97538 134.1
[M+H-H2O]+ 149.00948 122.1
[M+HCOO]- 211.01042 140.7
[M+CH3COO]- 225.02607 177.7
[M+Na-2H]- 186.98689 130.9
[M]+ 166.01167 133.4
[M]- 166.01277 133.4
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.