CID 154577028

3-bromo-2-fluoro-n,n-dimethylpyridin-4-amine

Structural Information

Molecular Formula
C7H8BrFN2
SMILES
CN(C)C1=C(C(=NC=C1)F)Br
InChI
InChI=1S/C7H8BrFN2/c1-11(2)5-3-4-10-7(9)6(5)8/h3-4H,1-2H3
InChIKey
LPKWMQOVUAANKZ-UHFFFAOYSA-N
Compound name
3-bromo-2-fluoro-N,N-dimethylpyridin-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

217.98549 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 218.99277 135.4
[M+Na]+ 240.97471 148.0
[M-H]- 216.97821 141.1
[M+NH4]+ 236.01931 157.0
[M+K]+ 256.94865 137.9
[M+H-H2O]+ 200.98275 133.9
[M+HCOO]- 262.98369 157.3
[M+CH3COO]- 276.99934 191.2
[M+Na-2H]- 238.96016 143.3
[M]+ 217.98494 153.8
[M]- 217.98604 153.8
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.