CID 77230354

2-bromo-1,1-dimethylcyclopentane

Structural Information

Molecular Formula
C7H13Br
SMILES
CC1(CCCC1Br)C
InChI
InChI=1S/C7H13Br/c1-7(2)5-3-4-6(7)8/h6H,3-5H2,1-2H3
InChIKey
YWAZLGZDMIGDHZ-UHFFFAOYSA-N
Compound name
2-bromo-1,1-dimethylcyclopentane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

176.02007 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 177.02735 136.9
[M+Na]+ 199.00929 138.5
[M+NH4]+ 194.05389 144.1
[M+K]+ 214.98323 137.9
[M-H]- 175.01279 137.4
[M+Na-2H]- 196.99474 139.9
[M]+ 176.01952 136.1
[M]- 176.02062 136.1
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.