CID 76801

Phenyl(tribromomethyl)mercury

Structural Information

Molecular Formula
C7H5Br3Hg
SMILES
C1=CC=C(C=C1)[Hg]C(Br)(Br)Br
InChI
InChI=1S/C6H5.CBr3.Hg/c1-2-4-6-5-3-1;2-1(3)4;/h1-5H;;
InChIKey
PLHSKXBFZPAQOD-UHFFFAOYSA-N
Compound name
phenyl(tribromomethyl)mercury
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

86
Patents

527.7648 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 528.77208 166.9
[M+Na]+ 550.75402 173.9
[M-H]- 526.75752 171.6
[M+NH4]+ 545.79862 181.1
[M+K]+ 566.72796 158.1
[M+H-H2O]+ 510.76206 181.3
[M+HCOO]- 572.76300 175.5
[M+CH3COO]- 586.77865 221.5
[M+Na-2H]- 548.73947 171.0
[M]+ 527.76425 207.1
[M]- 527.76535 207.1
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