CID 10978

N-butylmercuric chloride

Structural Information

Molecular Formula
C4H9ClHg
SMILES
CCCC[Hg]Cl
InChI
InChI=1S/C4H9.ClH.Hg/c1-3-4-2;;/h1,3-4H2,2H3;1H;/q;;+1/p-1
InChIKey
OKPMTXZRMGMMOO-UHFFFAOYSA-M
Compound name
butyl(chloro)mercury
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

28
Patents

294.00992 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 295.01720 157.2
[M+Na]+ 316.99914 164.1
[M-H]- 293.00264 156.0
[M+NH4]+ 312.04374 179.3
[M+K]+ 332.97308 161.0
[M+H-H2O]+ 277.00718 152.1
[M+HCOO]- 339.00812 174.6
[M+CH3COO]- 353.02377 175.9
[M+Na-2H]- 314.98459 160.5
[M]+ 294.00937 160.0
[M]- 294.01047 160.0
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