CID 23052

1,4-oxamercurane

Structural Information

Molecular Formula
C4H8HgO
SMILES
C1C[Hg]CCO1
InChI
InChI=1S/C4H8O.Hg/c1-3-5-4-2;/h1-4H2;
InChIKey
GNYWJHWUPSJHPZ-UHFFFAOYSA-N
Compound name
1-oxa-4-mercuracyclohexane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

274.02817 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 275.03545 151.9
[M+Na]+ 297.01739 155.4
[M-H]- 273.02089 153.9
[M+NH4]+ 292.06199 171.8
[M+K]+ 312.99133 155.8
[M+H-H2O]+ 257.02543 144.9
[M+HCOO]- 319.02637 170.6
[M+CH3COO]- 333.04202 168.8
[M+Na-2H]- 295.00284 157.1
[M]+ 274.02762 147.8
[M]- 274.02872 147.8
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.