CID 1393759

773872-39-2

Structural Information

Molecular Formula

C₁₃H₁₁ClO

SMILES

C1=CC(=CC(=C1)C2=CC=C(C=C2)Cl)CO

InChI

InChI=1S/C13H11ClO/c14-13-6-4-11(5-7-13)12-3-1-2-10(8-12)9-15/h1-8,15H,9H2

InChIKey

WBRGFIOYXJHTHH-UHFFFAOYSA-N

Compound name

[3-(4-chlorophenyl)phenyl]methanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 4
Patents: 218.04984 Da
Monoisotopic Mass: 3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	219.057116	144.6
[M+Na]+	241.039058	154.0
[M-H]-	217.042564	150.2
[M+NH4]+	236.083663	163.5
[M+K]+	257.012998	148.1
[M+H-H2O]+	201.047100	138.9
[M+HCOO]-	263.048041	163.5
[M+CH3COO]-	277.063691	184.5
[M+Na-2H]-	239.024506	150.9
[M]+	218.04929142	145.9
[M]-	218.05038858	145.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe