CID 1392897

773871-79-7

Structural Information

Molecular Formula

C₁₃H₁₁FO

SMILES

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

InChI

InChI=1S/C13H11FO/c14-13-6-4-11(5-7-13)12-3-1-2-10(8-12)9-15/h1-8,15H,9H2

InChIKey

JJAPITJSVHLHNH-UHFFFAOYSA-N

Compound name

[3-(4-fluorophenyl)phenyl]methanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 4
Patents: 202.07939 Da
Monoisotopic Mass: 2.8
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]+	203.08667	141.1
[M+Na]+	225.06861	149.7
[M-H]-	201.07211	145.6
[M+NH4]+	220.11321	159.7
[M+K]+	241.04255	145.2
[M+H-H2O]+	185.07665	133.7
[M+HCOO]-	247.07759	163.5
[M+CH3COO]-	261.09324	183.4
[M+Na-2H]-	223.05406	147.3
[M]+	202.07884	139.1
[M]-	202.07994	139.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe