CID 206639

28335-55-9

Structural Information

Molecular Formula

C₁₀H₂₄S₂

SMILES

C[S+](C)CCCCCC[S+](C)C

InChI

InChI=1S/C10H24S2/c1-11(2)9-7-5-6-8-10-12(3)4/h5-10H2,1-4H3/q+2

InChIKey

FWKMISGRFTVIPA-UHFFFAOYSA-N

Compound name

6-dimethylsulfoniohexyl(dimethyl)sulfanium

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 11
Patents: 208.13194 Da
Monoisotopic Mass: 3.0
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]+	209.13922	141.2
[M+Na]+	231.12116	145.9
[M-H]-	207.12466	141.5
[M+NH4]+	226.16576	160.0
[M+K]+	247.09510	132.9
[M+H-H2O]+	191.12920	141.0
[M+HCOO]-	253.13014	149.7
[M+CH3COO]-	267.14579	178.2
[M+Na-2H]-	229.10661	142.6
[M]+	208.13139	141.9
[M]-	208.13249	141.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe