CID 6588

1,1,2,2-tetrabromoethane

Structural Information

Molecular Formula
C2H2Br4
SMILES
C(C(Br)Br)(Br)Br
InChI
InChI=1S/C2H2Br4/c3-1(4)2(5)6/h1-2H
InChIKey
QXSZNDIIPUOQMB-UHFFFAOYSA-N
Compound name
1,1,2,2-tetrabromoethane
Related CIDs

2D Structure

compound 2d structure
7
Annotation Hits

12
References

5945
Patents

341.689 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 342.696276 141.4
[M+Na]+ 364.678218 148.3
[M-H]- 340.681724 144.7
[M+NH4]+ 359.722823 153.1
[M+K]+ 380.652158 134.7
[M+H-H2O]+ 324.686260 159.5
[M+HCOO]- 386.687201 147.1
[M+CH3COO]- 400.702851 230.2
[M+Na-2H]- 362.663666 144.8
[M]+ 341.68845142 179.0
[M]- 341.68954858 179.0
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