CID 91759511

3-bromo-2,6-dichloro-4-methylpyridine

Structural Information

Molecular Formula
C6H4BrCl2N
SMILES
CC1=CC(=NC(=C1Br)Cl)Cl
InChI
InChI=1S/C6H4BrCl2N/c1-3-2-4(8)10-6(9)5(3)7/h2H,1H3
InChIKey
GWIKWGBKSWHTOX-UHFFFAOYSA-N
Compound name
3-bromo-2,6-dichloro-4-methylpyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
Patents

238.89043 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 239.89771 131.7
[M+Na]+ 261.87965 147.6
[M-H]- 237.88315 136.9
[M+NH4]+ 256.92425 153.8
[M+K]+ 277.85359 134.0
[M+H-H2O]+ 221.88769 133.6
[M+HCOO]- 283.88863 144.1
[M+CH3COO]- 297.90428 187.3
[M+Na-2H]- 259.86510 139.7
[M]+ 238.88988 153.0
[M]- 238.89098 153.0
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