CID 130160487

2-bromobicyclo[3.1.0]hexane

Structural Information

Molecular Formula
C6H9Br
SMILES
C1CC(C2C1C2)Br
InChI
InChI=1S/C6H9Br/c7-6-2-1-4-3-5(4)6/h4-6H,1-3H2
InChIKey
CVXXZAQAJVPJLE-UHFFFAOYSA-N
Compound name
2-bromobicyclo[3.1.0]hexane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

159.98875 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 160.99603 130.5
[M+Na]+ 182.97797 144.5
[M-H]- 158.98147 138.6
[M+NH4]+ 178.02257 153.0
[M+K]+ 198.95191 133.8
[M+H-H2O]+ 142.98601 131.3
[M+HCOO]- 204.98695 151.3
[M+CH3COO]- 219.00260 179.2
[M+Na-2H]- 180.96342 138.0
[M]+ 159.98820 148.8
[M]- 159.98930 148.8
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.