CID 65441024

1-(bromomethyl)-3-methylcyclopentane

Structural Information

Molecular Formula
C7H13Br
SMILES
CC1CCC(C1)CBr
InChI
InChI=1S/C7H13Br/c1-6-2-3-7(4-6)5-8/h6-7H,2-5H2,1H3
InChIKey
JCORFEUVKWJDFB-UHFFFAOYSA-N
Compound name
1-(bromomethyl)-3-methylcyclopentane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
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 136.5
[M+Na]+ 199.00929 138.1
[M+NH4]+ 194.05389 142.5
[M+K]+ 214.98323 138.8
[M-H]- 175.01279 137.1
[M+Na-2H]- 196.99474 138.3
[M]+ 176.01952 135.6
[M]- 176.02062 135.6
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

patents stripe