CID 31934

Methyl-(bromomercuri)formate

Structural Information

Molecular Formula

C₂H₃BrHgO₂

SMILES

COC(=O)[Hg]Br

InChI

InChI=1S/C2H3O2.BrH.Hg/c1-4-2-3;;/h1H3;1H;/q;;+1/p-1

InChIKey

CILHWBRDXGBHHQ-UHFFFAOYSA-M

Compound name

bromo(methoxycarbonyl)mercury

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 339.90228 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]+	340.90956	157.1
[M+Na]+	362.89150	167.6
[M-H]-	338.89500	159.3
[M+NH4]+	357.93610	179.8
[M+K]+	378.86544	157.9
[M+H-H2O]+	322.89954	156.4
[M+HCOO]-	384.90048	176.9
[M+CH3COO]-	398.91613	179.7
[M+Na-2H]-	360.87695	161.7
[M]+	339.90173	177.0
[M]-	339.90283	177.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe