CID 2735995

2',5-dichloro-2-hydroxybenzophenone

Structural Information

Molecular Formula
C13H8Cl2O2
SMILES
C1=CC=C(C(=C1)C(=O)C2=C(C=CC(=C2)Cl)O)Cl
InChI
InChI=1S/C13H8Cl2O2/c14-8-5-6-12(16)10(7-8)13(17)9-3-1-2-4-11(9)15/h1-7,16H
InChIKey
OSXVZDOVYCTYCW-UHFFFAOYSA-N
Compound name
(5-chloro-2-hydroxyphenyl)-(2-chlorophenyl)methanone
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

28
Patents

265.99014 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 266.99742 151.4
[M+Na]+ 288.97936 162.0
[M-H]- 264.98286 156.9
[M+NH4]+ 284.02396 168.9
[M+K]+ 304.95330 155.5
[M+H-H2O]+ 248.98740 146.7
[M+HCOO]- 310.98834 164.7
[M+CH3COO]- 325.00399 192.3
[M+Na-2H]- 286.96481 155.2
[M]+ 265.98959 154.6
[M]- 265.99069 154.6
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