CID 6437823

Einecs 237-087-1

Structural Information

Molecular Formula
C4H6Cl2
SMILES
C/C=C(/CCl)\Cl
InChI
InChI=1S/C4H6Cl2/c1-2-4(6)3-5/h2H,3H2,1H3/b4-2-
InChIKey
VOGHDWQJCXXBMH-RQOWECAXSA-N
Compound name
(Z)-1,2-dichlorobut-2-ene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

91
Patents

123.98466 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 124.99194 119.5
[M+Na]+ 146.97388 128.8
[M-H]- 122.97738 119.5
[M+NH4]+ 142.01848 143.1
[M+K]+ 162.94782 125.1
[M+H-H2O]+ 106.98192 117.6
[M+HCOO]- 168.98286 133.5
[M+CH3COO]- 182.99851 169.5
[M+Na-2H]- 144.95933 125.4
[M]+ 123.98411 121.1
[M]- 123.98521 121.1
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