CID 75917

Thiometon sulfoxide

Structural Information

Molecular Formula
C6H15O3PS3
SMILES
CCS(=O)CCSP(=S)(OC)OC
InChI
InChI=1S/C6H15O3PS3/c1-4-13(7)6-5-12-10(11,8-2)9-3/h4-6H2,1-3H3
InChIKey
UILALIJMTSYZSE-UHFFFAOYSA-N
Compound name
2-ethylsulfinylethylsulfanyl-dimethoxy-sulfanylidene-lambda5-phosphane
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

261.9921 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 262.99938 149.3
[M+Na]+ 284.98132 154.9
[M-H]- 260.98482 147.3
[M+NH4]+ 280.02592 166.3
[M+K]+ 300.95526 150.5
[M+H-H2O]+ 244.98936 140.6
[M+HCOO]- 306.99030 160.0
[M+CH3COO]- 321.00595 193.6
[M+Na-2H]- 282.96677 146.3
[M]+ 261.99155 154.3
[M]- 261.99265 154.3
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.