CID 13081735

4-bromo-2,6-dimethylpyridine

Structural Information

Molecular Formula
C7H8BrN
SMILES
CC1=CC(=CC(=N1)C)Br
InChI
InChI=1S/C7H8BrN/c1-5-3-7(8)4-6(2)9-5/h3-4H,1-2H3
InChIKey
VTRFAYHJKSKHGY-UHFFFAOYSA-N
Compound name
4-bromo-2,6-dimethylpyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

821
Patents

184.98401 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 185.99129 129.3
[M+Na]+ 207.97323 134.4
[M+NH4]+ 203.01783 135.1
[M+K]+ 223.94717 133.7
[M-H]- 183.97673 130.4
[M+Na-2H]- 205.95868 134.3
[M]+ 184.98346 129.3
[M]- 184.98456 129.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

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