CID 4387163

Chloro(3,4-dimethylphenyl)mercury

Structural Information

Molecular Formula
C8H9ClHg
SMILES
CC1=C(C=C(C=C1)[Hg]Cl)C
InChI
InChI=1S/C8H9.ClH.Hg/c1-7-5-3-4-6-8(7)2;;/h3,5-6H,1-2H3;1H;/q;;+1/p-1
InChIKey
UANQYEYTKQDPMK-UHFFFAOYSA-M
Compound name
chloro-(3,4-dimethylphenyl)mercury
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

342.00992 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 343.01720 165.8
[M+Na]+ 364.99914 174.5
[M-H]- 341.00264 168.4
[M+NH4]+ 360.04374 186.5
[M+K]+ 380.97308 169.6
[M+H-H2O]+ 325.00718 159.7
[M+HCOO]- 387.00812 183.7
[M+CH3COO]- 401.02377 185.1
[M+Na-2H]- 362.98459 168.4
[M]+ 342.00937 168.5
[M]- 342.01047 168.5
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

patents stripe