CID 16683050

Sodium butylmercuric thioglycollate

Structural Information

Molecular Formula
C6H12HgO2S
SMILES
CCCC[Hg]OC(=O)CS
InChI
InChI=1S/C4H9.C2H4O2S.Hg/c1-3-4-2;3-2(4)1-5;/h1,3-4H2,2H3;5H,1H2,(H,3,4);/q;;+1/p-1
InChIKey
RTSXFTOWSJJJDL-UHFFFAOYSA-M
Compound name
butyl-(2-sulfanylacetyl)oxymercury
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

350.02646 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 351.03374 172.4
[M+Na]+ 373.01568 177.7
[M-H]- 349.01918 171.2
[M+NH4]+ 368.06028 191.7
[M+K]+ 388.98962 175.8
[M+H-H2O]+ 333.02372 165.3
[M+HCOO]- 395.02466 187.9
[M+CH3COO]- 409.04031 184.8
[M+Na-2H]- 371.00113 170.3
[M]+ 350.02591 177.7
[M]- 350.02701 177.7
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.