CID 12768468

1-bromo-2-methylcyclopentane

Structural Information

Molecular Formula
C6H11Br
SMILES
CC1CCCC1Br
InChI
InChI=1S/C6H11Br/c1-5-3-2-4-6(5)7/h5-6H,2-4H2,1H3
InChIKey
PBTRPYSJSYFLRJ-UHFFFAOYSA-N
Compound name
1-bromo-2-methylcyclopentane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

32
Patents

162.00441 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 163.01169 132.0
[M+Na]+ 184.99363 133.8
[M+NH4]+ 180.03823 138.2
[M+K]+ 200.96757 134.8
[M-H]- 160.99713 132.6
[M+Na-2H]- 182.97908 134.1
[M]+ 162.00386 131.1
[M]- 162.00496 131.1
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