CID 17865

10-chlorophenoxarsine

Structural Information

Molecular Formula

C₁₂H₈AsClO

SMILES

C1=CC=C2C(=C1)OC3=CC=CC=C3[As]2Cl

InChI

InChI=1S/C12H8AsClO/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1-8H

InChIKey

RUZFPOBOXIDMSZ-UHFFFAOYSA-N

Compound name

10-chlorophenoxarsinine

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 0
References: 35
Patents: 277.94797 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]+	278.95525	150.5
[M+Na]+	300.93719	168.1
[M+NH4]+	295.98179	162.1
[M+K]+	316.91113	158.0
[M-H]-	276.94069	156.9
[M+Na-2H]-	298.92264	158.6
[M]+	277.94742	155.5
[M]-	277.94852	155.5

Literature stripe

literature stripe

Patent stripe

patents stripe