CID 10798146

126717-59-7

Structural Information

Molecular Formula
C7H8BrNO
SMILES
CC1=C(C=CC(=N1)OC)Br
InChI
InChI=1S/C7H8BrNO/c1-5-6(8)3-4-7(9-5)10-2/h3-4H,1-2H3
InChIKey
VWNXCCTWVAQAPL-UHFFFAOYSA-N
Compound name
3-bromo-6-methoxy-2-methylpyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

268
Patents

200.97893 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 201.98621 132.8
[M+Na]+ 223.96815 137.5
[M+NH4]+ 219.01275 138.1
[M+K]+ 239.94209 137.2
[M-H]- 199.97165 133.4
[M+Na-2H]- 221.95360 137.3
[M]+ 200.97838 132.5
[M]- 200.97948 132.5
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

patents stripe