CID 97725878

1-(5-bromopyridin-2-yl)cyclopentan-1-amine

Structural Information

Molecular Formula
C10H13BrN2
SMILES
C1CCC(C1)(C2=NC=C(C=C2)Br)N
InChI
InChI=1S/C10H13BrN2/c11-8-3-4-9(13-7-8)10(12)5-1-2-6-10/h3-4,7H,1-2,5-6,12H2
InChIKey
ROUXMWNZNHQVPQ-UHFFFAOYSA-N
Compound name
1-(5-bromopyridin-2-yl)cyclopentan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

240.02621 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 241.03349 146.3
[M+Na]+ 263.01543 156.7
[M-H]- 239.01893 153.7
[M+NH4]+ 258.06003 169.2
[M+K]+ 278.98937 145.4
[M+H-H2O]+ 223.02347 145.8
[M+HCOO]- 285.02441 166.8
[M+CH3COO]- 299.04006 160.8
[M+Na-2H]- 261.00088 152.6
[M]+ 240.02566 160.5
[M]- 240.02676 160.5
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.