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

Adduct m/z Predicted CCS (Ų)
[M+H]+ 222.845986 135.4
[M+Na]+ 244.827928 145.3
[M-H]- 220.831434 134.2
[M+NH4]+ 239.872533 156.7
[M+K]+ 260.801868 140.2
[M+H-H2O]+ 204.835970 133.8
[M+HCOO]- 266.836911 143.4
[M+CH3COO]- 280.852561 175.0
[M+Na-2H]- 242.813376 141.0
[M]+ 221.83816142 137.2
[M]- 221.83925858 137.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.