CID 6433174

Lewisite i oxide

Structural Information

Molecular Formula

C₂H₂AsCl₃O

SMILES

C(=C/[As](=O)(Cl)Cl)\Cl

InChI

InChI=1S/C2H2AsCl3O/c4-2-1-3(5,6)7/h1-2H/b2-1+

InChIKey

UQKJRDWYYZHIOR-OWOJBTEDSA-N

Compound name

(E)-1-chloro-2-dichloroarsorylethene

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 221.83871 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]+	222.84599	134.1
[M+Na]+	244.82793	146.6
[M+NH4]+	239.87253	142.4
[M+K]+	260.80187	139.5
[M-H]-	220.83143	132.7
[M+Na-2H]-	242.81338	138.5
[M]+	221.83816	136.2
[M]-	221.83926	136.2

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.