CID 25622

2,2'-dichlorobiphenyl

Structural Information

Molecular Formula
C12H8Cl2
SMILES
C1=CC=C(C(=C1)C2=CC=CC=C2Cl)Cl
InChI
InChI=1S/C12H8Cl2/c13-11-7-3-1-5-9(11)10-6-2-4-8-12(10)14/h1-8H
InChIKey
JAYCNKDKIKZTAF-UHFFFAOYSA-N
Compound name
1-chloro-2-(2-chlorophenyl)benzene
Related CIDs

2D Structure

compound 2d structure
5
Annotation Hits

35
References

2370
Patents

222.0003 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 223.00758 142.6
[M+Na]+ 244.98952 153.3
[M-H]- 220.99302 148.9
[M+NH4]+ 240.03412 162.4
[M+K]+ 260.96346 146.6
[M+H-H2O]+ 204.99756 137.5
[M+HCOO]- 266.99850 157.9
[M+CH3COO]- 281.01415 156.3
[M+Na-2H]- 242.97497 149.1
[M]+ 221.99975 145.2
[M]- 222.00085 145.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.