CID 18324003

(1-bromoethyl)cyclopentane

Structural Information

Molecular Formula
C7H13Br
SMILES
CC(C1CCCC1)Br
InChI
InChI=1S/C7H13Br/c1-6(8)7-4-2-3-5-7/h6-7H,2-5H2,1H3
InChIKey
AVDASXICTKXEII-UHFFFAOYSA-N
Compound name
1-bromoethylcyclopentane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

21
Patents

176.02007 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 177.02735 136.2
[M+Na]+ 199.00929 137.2
[M+NH4]+ 194.05389 142.1
[M+K]+ 214.98323 138.5
[M-H]- 175.01279 136.6
[M+Na-2H]- 196.99474 137.9
[M]+ 176.01952 135.1
[M]- 176.02062 135.1
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