CID 44144408

Mercurol

Structural Information

Molecular Formula
C4H4Hg
SMILES
C1=C[Hg]C=C1
InChI
InChI=1S/C4H4.Hg/c1-3-4-2;/h1-4H;
InChIKey
DMNGXBPFKNBWTD-UHFFFAOYSA-N
Compound name
1-mercuracyclopenta-2,4-diene
Related CIDs

2D Structure

compound 2d structure
5
Annotation Hits

0
References

1
Patents

254.00194 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 255.00922 146.1
[M+Na]+ 276.99116 152.7
[M-H]- 252.99466 148.4
[M+NH4]+ 272.03576 170.2
[M+K]+ 292.96510 151.2
[M+H-H2O]+ 236.99920 139.5
[M+HCOO]- 299.00014 170.6
[M+CH3COO]- 313.01579 166.2
[M+Na-2H]- 274.97661 150.9
[M]+ 254.00139 145.0
[M]- 254.00249 145.0
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