CID 12292907

2-(4-chlorobenzoyl)benzoyl chloride

Structural Information

Molecular Formula
C14H8Cl2O2
SMILES
C1=CC=C(C(=C1)C(=O)C2=CC=C(C=C2)Cl)C(=O)Cl
InChI
InChI=1S/C14H8Cl2O2/c15-10-7-5-9(6-8-10)13(17)11-3-1-2-4-12(11)14(16)18/h1-8H
InChIKey
WUSKUMDOLSBRHW-UHFFFAOYSA-N
Compound name
2-(4-chlorobenzoyl)benzoyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

42
Patents

277.99014 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 278.99742 156.7
[M+Na]+ 300.97936 173.2
[M+NH4]+ 296.02396 165.8
[M+K]+ 316.95330 164.7
[M-H]- 276.98286 160.9
[M+Na-2H]- 298.96481 166.2
[M]+ 277.98959 161.0
[M]- 277.99069 161.0
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

patents stripe