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

1705
Patents

416.03363 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 417.04091 186.2
[M+Na]+ 439.02285 191.6
[M-H]- 415.02635 190.1
[M+NH4]+ 434.06745 201.0
[M+K]+ 454.99679 187.4
[M+H-H2O]+ 399.03089 176.9
[M+HCOO]- 461.03183 206.7
[M+CH3COO]- 475.04748 193.6
[M+Na-2H]- 437.00830 187.9
[M]+ 416.03308 186.6
[M]- 416.03418 186.6
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