CID 534192

1,1-dibromo-2,2-bis(chloromethyl)cyclopropane

Structural Information

Molecular Formula
C5H6Br2Cl2
SMILES
C1C(C1(Br)Br)(CCl)CCl
InChI
InChI=1S/C5H6Br2Cl2/c6-5(7)1-4(5,2-8)3-9/h1-3H2
InChIKey
RCRVZCIUKQNOIS-UHFFFAOYSA-N
Compound name
1,1-dibromo-2,2-bis(chloromethyl)cyclopropane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

235
Patents

293.82132 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 294.82860 135.2
[M+Na]+ 316.81054 150.4
[M-H]- 292.81404 142.9
[M+NH4]+ 311.85514 155.0
[M+K]+ 332.78448 133.3
[M+H-H2O]+ 276.81858 146.0
[M+HCOO]- 338.81952 144.3
[M+CH3COO]- 352.83517 202.8
[M+Na-2H]- 314.79599 144.2
[M]+ 293.82077 171.3
[M]- 293.82187 171.3
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.