CID 16683048

2,6-bis(acetoxymercuri)-4-nitroaniline

Structural Information

Molecular Formula
C10H10Hg2N2O6
SMILES
CC(=O)O[Hg]C1=CC(=CC(=C1N)[Hg]OC(=O)C)[N+](=O)[O-]
InChI
InChI=1S/C6H4N2O2.2C2H4O2.2Hg/c7-5-1-3-6(4-2-5)8(9)10;2*1-2(3)4;;/h3-4H,7H2;2*1H3,(H,3,4);;/q;;;2*+1/p-2
InChIKey
AHJYJMLFISCYBM-UHFFFAOYSA-L
Compound name
acetyloxy-[3-(acetyloxymercurio)-2-amino-5-nitrophenyl]mercury
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

657.9952 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 659.00248 218.0
[M+Na]+ 680.98442 226.0
[M+NH4]+ 676.02902 220.9
[M+K]+ 696.95836 222.5
[M-H]- 656.98792 217.9
[M+Na-2H]- 678.96987 216.2
[M]+ 657.99465 218.3
[M]- 657.99575 218.3
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.