CID 51356623

3-bromo-5-chloro-n-methylpyridin-2-amine

Structural Information

Molecular Formula
C6H6BrClN2
SMILES
CNC1=C(C=C(C=N1)Cl)Br
InChI
InChI=1S/C6H6BrClN2/c1-9-6-5(7)2-4(8)3-10-6/h2-3H,1H3,(H,9,10)
InChIKey
YFAHCYUOTLPTBE-UHFFFAOYSA-N
Compound name
3-bromo-5-chloro-N-methylpyridin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

219.94029 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 220.947566 132.6
[M+Na]+ 242.929508 146.2
[M-H]- 218.933014 138.0
[M+NH4]+ 237.974113 154.4
[M+K]+ 258.903448 133.5
[M+H-H2O]+ 202.937550 132.9
[M+HCOO]- 264.938491 150.8
[M+CH3COO]- 278.954141 186.1
[M+Na-2H]- 240.914956 141.9
[M]+ 219.93974142 152.2
[M]- 219.94083858 152.2
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

patents stripe