CID 16683676

Phenylmercury salicylate

Structural Information

Molecular Formula

C₁₃H₁₀HgO₃

SMILES

C1=CC=C(C=C1)[Hg]OC(=O)C2=CC=CC=C2O

InChI

InChI=1S/C7H6O3.C6H5.Hg/c8-6-4-2-1-3-5(6)7(9)10;1-2-4-6-5-3-1;/h1-4,8H,(H,9,10);1-5H;/q;;+1/p-1

InChIKey

YQRBOMYQIMHOLM-UHFFFAOYSA-M

Compound name

(2-hydroxybenzoyl)oxy-phenylmercury

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1756
Patents: 416.03363 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]+	417.040906	186.2
[M+Na]+	439.022848	191.6
[M-H]-	415.026354	190.1
[M+NH4]+	434.067453	201.0
[M+K]+	454.996788	187.4
[M+H-H2O]+	399.030890	176.9
[M+HCOO]-	461.031831	206.7
[M+CH3COO]-	475.047481	193.6
[M+Na-2H]-	437.008296	187.9
[M]+	416.03308142	186.6
[M]-	416.03417858	186.6

Literature stripe

literature stripe

Patent stripe

patents stripe