CID 130055558

2-bromo-5,6-dimethylpyridin-3-amine

Structural Information

Molecular Formula
C7H9BrN2
SMILES
CC1=CC(=C(N=C1C)Br)N
InChI
InChI=1S/C7H9BrN2/c1-4-3-6(9)7(8)10-5(4)2/h3H,9H2,1-2H3
InChIKey
UDEJDHHSZGOBGI-UHFFFAOYSA-N
Compound name
2-bromo-5,6-dimethylpyridin-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

13
Patents

199.9949 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 201.00218 132.7
[M+Na]+ 222.98412 145.9
[M-H]- 198.98762 138.1
[M+NH4]+ 218.02872 154.4
[M+K]+ 238.95806 134.5
[M+H-H2O]+ 182.99216 132.3
[M+HCOO]- 244.99310 154.4
[M+CH3COO]- 259.00875 185.8
[M+Na-2H]- 220.96957 140.1
[M]+ 199.99435 150.3
[M]- 199.99545 150.3
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