CID 14003068

2,3-dibromo-5,6-dimethylpyridine

Structural Information

Molecular Formula
C7H7Br2N
SMILES
CC1=CC(=C(N=C1C)Br)Br
InChI
InChI=1S/C7H7Br2N/c1-4-3-6(8)7(9)10-5(4)2/h3H,1-2H3
InChIKey
GQJNLDKZLUATAH-UHFFFAOYSA-N
Compound name
2,3-dibromo-5,6-dimethylpyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

30
Patents

262.89453 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 263.901806 129.3
[M+Na]+ 285.883748 142.1
[M-H]- 261.887254 135.9
[M+NH4]+ 280.928353 149.4
[M+K]+ 301.857688 127.0
[M+H-H2O]+ 245.891790 137.8
[M+HCOO]- 307.892731 145.7
[M+CH3COO]- 321.908381 200.0
[M+Na-2H]- 283.869196 137.7
[M]+ 262.89398142 164.1
[M]- 262.89507858 164.1
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