CID 16682924

Merpectogel

Structural Information

Molecular Formula
C6H5HgNO3
SMILES
C1=CC=C(C=C1)[Hg]O[N+](=O)[O-]
InChI
InChI=1S/C6H5.Hg.NO3/c1-2-4-6-5-3-1;;2-1(3)4/h1-5H;;/q;+1;-1
InChIKey
PDTFCHSETJBPTR-UHFFFAOYSA-N
Compound name
nitrooxy(phenyl)mercury
Related CIDs

2D Structure

compound 2d structure
7
Annotation Hits

33
References

29018
Patents

340.9976 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 342.00488 156.4
[M+Na]+ 363.98682 169.0
[M+NH4]+ 359.03142 164.3
[M+K]+ 379.96076 163.8
[M-H]- 339.99032 159.4
[M+Na-2H]- 361.97227 161.9
[M]+ 340.99705 158.8
[M]- 340.99815 158.8
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

patents stripe