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]+ 222.84599 135.4
[M+Na]+ 244.82793 145.3
[M-H]- 220.83143 134.2
[M+NH4]+ 239.87253 156.7
[M+K]+ 260.80187 140.2
[M+H-H2O]+ 204.83597 133.8
[M+HCOO]- 266.83691 143.4
[M+CH3COO]- 280.85256 175.0
[M+Na-2H]- 242.81338 141.0
[M]+ 221.83816 137.2
[M]- 221.83926 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.