CID 12651155

1,1-bis(bromomethyl)cyclobutane

Structural Information

Molecular Formula
C6H10Br2
SMILES
C1CC(C1)(CBr)CBr
InChI
InChI=1S/C6H10Br2/c7-4-6(5-8)2-1-3-6/h1-5H2
InChIKey
YMLYUDXIHNNLAJ-UHFFFAOYSA-N
Compound name
1,1-bis(bromomethyl)cyclobutane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

52
Patents

239.91493 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 240.92221 119.3
[M+Na]+ 262.90415 129.2
[M-H]- 238.90765 126.3
[M+NH4]+ 257.94875 137.1
[M+K]+ 278.87809 117.1
[M+H-H2O]+ 222.91219 125.7
[M+HCOO]- 284.91313 134.8
[M+CH3COO]- 298.92878 197.8
[M+Na-2H]- 260.88960 129.0
[M]+ 239.91438 158.1
[M]- 239.91548 158.1
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