CID 129216015

3-bromo-5-fluoro-6-methylpyridin-2-amine

Structural Information

Molecular Formula
C6H6BrFN2
SMILES
CC1=NC(=C(C=C1F)Br)N
InChI
InChI=1S/C6H6BrFN2/c1-3-5(8)2-4(7)6(9)10-3/h2H,1H3,(H2,9,10)
InChIKey
DOSDISHQWXMJDQ-UHFFFAOYSA-N
Compound name
3-bromo-5-fluoro-6-methylpyridin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

24
Patents

203.96983 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 204.97711 131.8
[M+Na]+ 226.95905 145.4
[M-H]- 202.96255 136.0
[M+NH4]+ 222.00365 153.3
[M+K]+ 242.93299 133.9
[M+H-H2O]+ 186.96709 130.7
[M+HCOO]- 248.96803 152.9
[M+CH3COO]- 262.98368 185.5
[M+Na-2H]- 224.94450 139.1
[M]+ 203.96928 148.1
[M]- 203.97038 148.1
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