CID 7270

1,2,4,5-tetrachlorobenzene

Structural Information

Molecular Formula
C6H2Cl4
SMILES
C1=C(C(=CC(=C1Cl)Cl)Cl)Cl
InChI
InChI=1S/C6H2Cl4/c7-3-1-4(8)6(10)2-5(3)9/h1-2H
InChIKey
JHBKHLUZVFWLAG-UHFFFAOYSA-N
Compound name
1,2,4,5-tetrachlorobenzene
Related CIDs

2D Structure

compound 2d structure
7
Annotation Hits

60
References

1489
Patents

213.89107 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 214.89835 138.6
[M+Na]+ 236.88029 154.9
[M+NH4]+ 231.92489 148.6
[M+K]+ 252.85423 145.9
[M-H]- 212.88379 141.0
[M+Na-2H]- 234.86574 146.5
[M]+ 213.89052 142.9
[M]- 213.89162 142.9
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