CID 119056910

3-bromo-5-cyclobutylpyridin-2-amine

Structural Information

Molecular Formula
C9H11BrN2
SMILES
C1CC(C1)C2=CC(=C(N=C2)N)Br
InChI
InChI=1S/C9H11BrN2/c10-8-4-7(5-12-9(8)11)6-2-1-3-6/h4-6H,1-3H2,(H2,11,12)
InChIKey
OKCDSBJYSZLAKJ-UHFFFAOYSA-N
Compound name
3-bromo-5-cyclobutylpyridin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

226.01056 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 227.01784 140.5
[M+Na]+ 248.99978 140.3
[M+NH4]+ 244.04438 142.5
[M+K]+ 264.97372 141.5
[M-H]- 225.00328 140.4
[M+Na-2H]- 246.98523 143.0
[M]+ 226.01001 138.2
[M]- 226.01111 138.2
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.