CID 40189

Arsine, dichloro(p-nitrophenyl)-

Structural Information

Molecular Formula

C₆H₄AsCl₂NO₂

SMILES

C1=CC(=CC=C1[N+](=O)[O-])[As](Cl)Cl

InChI

InChI=1S/C6H4AsCl2NO2/c8-7(9)5-1-3-6(4-2-5)10(11)12/h1-4H

InChIKey

QGHBRUGQGDWTSP-UHFFFAOYSA-N

Compound name

dichloro-(4-nitrophenyl)arsane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 7
References: 4
Patents: 266.8835 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]+	267.890776	148.7
[M+Na]+	289.872718	156.5
[M-H]-	265.876224	151.0
[M+NH4]+	284.917323	167.4
[M+K]+	305.846658	148.6
[M+H-H2O]+	249.880760	149.3
[M+HCOO]-	311.881701	163.7
[M+CH3COO]-	325.897351	179.4
[M+Na-2H]-	287.858166	153.9
[M]+	266.88295142	149.8
[M]-	266.88404858	149.8

Literature stripe

literature stripe

Patent stripe

patents stripe