CID 90545

2-chloromercuri-4-nitrophenol

Structural Information

Molecular Formula

C₆H₄ClHgNO₃

SMILES

C1=CC(=C(C=C1[N+](=O)[O-])[Hg]Cl)O

InChI

InChI=1S/C6H4NO3.ClH.Hg/c8-6-3-1-5(2-4-6)7(9)10;;/h1-3,8H;1H;/q;;+1/p-1

InChIKey

VIMWCINSBRXAQH-UHFFFAOYSA-M

Compound name

chloro-(2-hydroxy-5-nitrophenyl)mercury

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 12
References: 4473
Patents: 374.95862 Da
Monoisotopic Mass: None
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	375.96590	161.0
[M+Na]+	397.94784	174.6
[M+NH4]+	392.99244	168.8
[M+K]+	413.92178	169.3
[M-H]-	373.95134	163.5
[M+Na-2H]-	395.93329	165.6
[M]+	374.95807	163.7
[M]-	374.95917	163.7

Literature stripe

literature stripe

Patent stripe

patents stripe