CID 2360735

52803-70-0

Structural Information

Molecular Formula

C₁₄H₁₁ClO₃

SMILES

C1=CC=C(C(=C1)COC2=CC=CC=C2C(=O)O)Cl

InChI

InChI=1S/C14H11ClO3/c15-12-7-3-1-5-10(12)9-18-13-8-4-2-6-11(13)14(16)17/h1-8H,9H2,(H,16,17)

InChIKey

WIMYONIKOLZLBM-UHFFFAOYSA-N

Compound name

2-[(2-chlorophenyl)methoxy]benzoic acid

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 6
References: 6
Patents: 262.03967 Da
Monoisotopic Mass: 3.5
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]+	263.04695	155.2
[M+Na]+	285.02889	170.5
[M+NH4]+	280.07349	163.7
[M+K]+	301.00283	162.8
[M-H]-	261.03239	159.0
[M+Na-2H]-	283.01434	164.2
[M]+	262.03912	158.8
[M]-	262.04022	158.8

Literature stripe

literature stripe

Patent stripe

patents stripe