CID 10900

1,2-dichloroethylene

Structural Information

Molecular Formula
C2H2Cl2
SMILES
C(=CCl)Cl
InChI
InChI=1S/C2H2Cl2/c3-1-2-4/h1-2H
InChIKey
KFUSEUYYWQURPO-UHFFFAOYSA-N
Compound name
1,2-dichloroethene
Related CIDs

2D Structure

compound 2d structure
9
Annotation Hits

282
References

50526
Patents

95.953354 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 96.960630 110.4
[M+Na]+ 118.942572 120.6
[M-H]- 94.946078 110.5
[M+NH4]+ 113.987177 135.0
[M+K]+ 134.916512 117.2
[M+H-H2O]+ 78.950614 108.8
[M+HCOO]- 140.951555 125.9
[M+CH3COO]- 154.967205 162.8
[M+Na-2H]- 116.928020 118.6
[M]+ 95.95280542 111.7
[M]- 95.95390258 111.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe