CID 3457347

Chlorooctylmercury

Structural Information

Molecular Formula
C8H17ClHg
SMILES
CCCCCCCC[Hg]Cl
InChI
InChI=1S/C8H17.ClH.Hg/c1-3-5-7-8-6-4-2;;/h1,3-8H2,2H3;1H;/q;;+1/p-1
InChIKey
YUMXSIQMOHOYIH-UHFFFAOYSA-M
Compound name
chloro(octyl)mercury
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

350.0725 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 351.07978 175.9
[M+Na]+ 373.06172 181.1
[M-H]- 349.06522 173.9
[M+NH4]+ 368.10632 195.7
[M+K]+ 389.03566 176.8
[M+H-H2O]+ 333.06976 169.9
[M+HCOO]- 395.07070 192.0
[M+CH3COO]- 409.08635 187.9
[M+Na-2H]- 371.04717 176.9
[M]+ 350.07195 180.1
[M]- 350.07305 180.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.