CID 569907

(3-chlorophenyl)(phenyl)methanol

Structural Information

Molecular Formula
C13H11ClO
SMILES
C1=CC=C(C=C1)C(C2=CC(=CC=C2)Cl)O
InChI
InChI=1S/C13H11ClO/c14-12-8-4-7-11(9-12)13(15)10-5-2-1-3-6-10/h1-9,13,15H
InChIKey
DDCJHFYXAPQYLA-UHFFFAOYSA-N
Compound name
(3-chlorophenyl)-phenylmethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

995
Patents

218.04984 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 219.05712 144.8
[M+Na]+ 241.03906 153.0
[M-H]- 217.04256 150.2
[M+NH4]+ 236.08366 163.3
[M+K]+ 257.01300 147.5
[M+H-H2O]+ 201.04710 139.0
[M+HCOO]- 263.04804 162.7
[M+CH3COO]- 277.06369 184.3
[M+Na-2H]- 239.02451 150.7
[M]+ 218.04929 145.1
[M]- 218.05039 145.1
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