CID 16683056

(5-(hydroxymercuri)-2-thienyl)mercury acetate

Structural Information

Molecular Formula
C6H5Hg2O2S
SMILES
CC(=O)O[Hg]C1=CC=C(S1)[Hg]
InChI
InChI=1S/C4H2S.C2H4O2.2Hg/c1-2-4-5-3-1;1-2(3)4;;/h1-2H;1H3,(H,3,4);;/q;;;+1/p-1
InChIKey
HPNJPNWTAAELPC-UHFFFAOYSA-M
Compound name
acetyloxy-(5-mercuriothiophen-2-yl)mercury
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

544.9423 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 545.94958 209.3
[M+Na]+ 567.93152 215.2
[M-H]- 543.93502 210.7
[M+NH4]+ 562.97612 228.2
[M+K]+ 583.90546 211.6
[M+H-H2O]+ 527.93956 200.4
[M+HCOO]- 589.94050 224.9
[M+CH3COO]- 603.95615 191.6
[M+Na-2H]- 565.91697 202.7
[M]+ 544.94175 213.7
[M]- 544.94285 213.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.