CID 79502

4-chlorophenylarsonic acid

Structural Information

Molecular Formula

C₆H₆AsClO₃

SMILES

C1=CC(=CC=C1Cl)[As](=O)(O)O

InChI

InChI=1S/C6H6AsClO3/c8-6-3-1-5(2-4-6)7(9,10)11/h1-4H,(H2,9,10,11)

InChIKey

OAKWMQGNBGGJGT-UHFFFAOYSA-N

Compound name

(4-chlorophenyl)arsonic acid

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 2
Patents: 235.92213 Da
Monoisotopic Mass: None
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]+	236.92941	139.3
[M+Na]+	258.91135	151.8
[M+NH4]+	253.95595	146.9
[M+K]+	274.88529	146.4
[M-H]-	234.91485	139.2
[M+Na-2H]-	256.89680	145.0
[M]+	235.92158	141.2
[M]-	235.92268	141.2

Literature stripe

literature stripe

Patent stripe

patents stripe