CID 7074

2-chloro-4-phenylphenol

Structural Information

Molecular Formula
C12H9ClO
SMILES
C1=CC=C(C=C1)C2=CC(=C(C=C2)O)Cl
InChI
InChI=1S/C12H9ClO/c13-11-8-10(6-7-12(11)14)9-4-2-1-3-5-9/h1-8,14H
InChIKey
BZWMYDJJDBFAPE-UHFFFAOYSA-N
Compound name
2-chloro-4-phenylphenol
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

8
References

448
Patents

204.0342 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 205.04148 140.7
[M+Na]+ 227.02342 157.8
[M+NH4]+ 222.06802 151.2
[M+K]+ 242.99736 148.8
[M-H]- 203.02692 146.2
[M+Na-2H]- 225.00887 151.7
[M]+ 204.03365 145.3
[M]- 204.03475 145.3
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