CID 12382

Dibutylmercury

Structural Information

Molecular Formula
C8H18Hg
SMILES
CCCC[Hg]CCCC
InChI
InChI=1S/2C4H9.Hg/c2*1-3-4-2;/h2*1,3-4H2,2H3;
InChIKey
CCYKQVBIPYDCKS-UHFFFAOYSA-N
Compound name
dibutylmercury
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

58
Patents

316.11148 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 317.118756 170.2
[M+Na]+ 339.100698 174.8
[M-H]- 315.104204 168.6
[M+NH4]+ 334.145303 190.7
[M+K]+ 355.074638 172.8
[M+H-H2O]+ 299.108740 163.6
[M+HCOO]- 361.109681 190.9
[M+CH3COO]- 375.125331 184.1
[M+Na-2H]- 337.086146 171.8
[M]+ 316.11093142 172.9
[M]- 316.11202858 172.9
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