CID 15645663

5-bromo-n-methylpyridin-2-amine

Structural Information

Molecular Formula
C6H7BrN2
SMILES
CNC1=NC=C(C=C1)Br
InChI
InChI=1S/C6H7BrN2/c1-8-6-3-2-5(7)4-9-6/h2-4H,1H3,(H,8,9)
InChIKey
KHPPOPZLVCZUPV-UHFFFAOYSA-N
Compound name
5-bromo-N-methylpyridin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

362
Patents

185.97926 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 186.98654 130.2
[M+Na]+ 208.96848 134.0
[M+NH4]+ 204.01308 135.6
[M+K]+ 224.94242 133.6
[M-H]- 184.97198 131.4
[M+Na-2H]- 206.95393 135.2
[M]+ 185.97871 129.9
[M]- 185.97981 129.9
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

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