CID 625085

1,2-dichloro-3,4-bis(dichloromethylene)cyclobutene

Structural Information

Molecular Formula
C6Cl6
SMILES
C1(=C(C(=C(Cl)Cl)C1=C(Cl)Cl)Cl)Cl
InChI
InChI=1S/C6Cl6/c7-3-1(5(9)10)2(4(3)8)6(11)12
InChIKey
CRBWLZHAYSNDPR-UHFFFAOYSA-N
Compound name
1,2-dichloro-3,4-bis(dichloromethylidene)cyclobutene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

281.8131 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 282.82038 154.4
[M+Na]+ 304.80232 163.8
[M+NH4]+ 299.84692 158.8
[M+K]+ 320.77626 157.7
[M-H]- 280.80582 151.9
[M+Na-2H]- 302.78777 156.6
[M]+ 281.81255 155.5
[M]- 281.81365 155.5
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

No patent data available for this compound.