CID 53438778

6-bromo-4,4'-dimethyl-2,2'-bipyridyl

Structural Information

Molecular Formula
C12H11BrN2
SMILES
CC1=CC(=NC=C1)C2=NC(=CC(=C2)C)Br
InChI
InChI=1S/C12H11BrN2/c1-8-3-4-14-10(5-8)11-6-9(2)7-12(13)15-11/h3-7H,1-2H3
InChIKey
UEJJXCRFGURPDR-UHFFFAOYSA-N
Compound name
2-bromo-4-methyl-6-(4-methylpyridin-2-yl)pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

32
Patents

262.01056 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 263.01784 147.9
[M+Na]+ 284.99978 161.1
[M-H]- 261.00328 155.2
[M+NH4]+ 280.04438 166.3
[M+K]+ 300.97372 149.1
[M+H-H2O]+ 245.00782 146.6
[M+HCOO]- 307.00876 168.0
[M+CH3COO]- 321.02441 162.9
[M+Na-2H]- 282.98523 156.1
[M]+ 262.01001 167.3
[M]- 262.01111 167.3
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