CID 85103

Mercury, chloro[4-[(2,4-dinitrophenyl)amino]phenyl]-

Structural Information

Molecular Formula
C12H8ClHgN3O4
SMILES
C1=CC(=CC=C1NC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])[Hg]Cl
InChI
InChI=1S/C12H8N3O4.ClH.Hg/c16-14(17)10-6-7-11(12(8-10)15(18)19)13-9-4-2-1-3-5-9;;/h2-8,13H;1H;/q;;+1/p-1
InChIKey
NRUITAHXRFYGBL-UHFFFAOYSA-M
Compound name
chloro-[4-(2,4-dinitroanilino)phenyl]mercury
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

494.99097 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 495.998246 203.8
[M+Na]+ 517.980188 207.3
[M-H]- 493.983694 208.3
[M+NH4]+ 513.024793 214.3
[M+K]+ 533.954128 194.1
[M+H-H2O]+ 477.988230 203.5
[M+HCOO]- 539.989171 223.6
[M+CH3COO]- 554.004821 202.0
[M+Na-2H]- 515.965636 207.7
[M]+ 494.99042142 202.3
[M]- 494.99151858 202.3
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.