CID 147421650

1-bromo-3-ethylcyclobutane

Structural Information

Molecular Formula
C6H11Br
SMILES
CCC1CC(C1)Br
InChI
InChI=1S/C6H11Br/c1-2-5-3-6(7)4-5/h5-6H,2-4H2,1H3
InChIKey
TXXKUXGTTHIKLV-UHFFFAOYSA-N
Compound name
1-bromo-3-ethylcyclobutane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

162.00441 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 163.01169 125.3
[M+Na]+ 184.99363 124.4
[M+NH4]+ 180.03823 128.0
[M+K]+ 200.96757 125.9
[M-H]- 160.99713 123.7
[M+Na-2H]- 182.97908 126.4
[M]+ 162.00386 122.6
[M]- 162.00496 122.6
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.