CID 31177

22439-22-1

Structural Information

Molecular Formula

C₃H₆Cl₂O₄S₂

SMILES

CS(=O)(=O)C(S(=O)(=O)C)(Cl)Cl

InChI

InChI=1S/C3H6Cl2O4S2/c1-10(6,7)3(4,5)11(2,8)9/h1-2H3

InChIKey

PORPUUUZTQOYIA-UHFFFAOYSA-N

Compound name

dichloro-bis(methylsulfonyl)methane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 5
Patents: 239.90846 Da
Monoisotopic Mass: 0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	240.91574	141.8
[M+Na]+	262.89768	151.5
[M-H]-	238.90118	143.1
[M+NH4]+	257.94228	160.9
[M+K]+	278.87162	146.9
[M+H-H2O]+	222.90572	140.1
[M+HCOO]-	284.90666	143.3
[M+CH3COO]-	298.92231	181.4
[M+Na-2H]-	260.88313	146.3
[M]+	239.90791	147.7
[M]-	239.90901	147.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe