CID 119096226

10555-43-8

Structural Information

Molecular Formula
C5H8Br2
SMILES
C1C(CC1Br)CBr
InChI
InChI=1S/C5H8Br2/c6-3-4-1-5(7)2-4/h4-5H,1-3H2
InChIKey
AUBRPPSAKCHCJU-UHFFFAOYSA-N
Compound name
1-bromo-3-(bromomethyl)cyclobutane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

225.89928 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 226.90656 115.3
[M+Na]+ 248.88850 125.5
[M-H]- 224.89200 122.2
[M+NH4]+ 243.93310 132.2
[M+K]+ 264.86244 113.5
[M+H-H2O]+ 208.89654 120.6
[M+HCOO]- 270.89748 130.9
[M+CH3COO]- 284.91313 196.7
[M+Na-2H]- 246.87395 124.1
[M]+ 225.89873 153.5
[M]- 225.89983 153.5
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.