CID 165883337

6-bromo-2-(chloromethyl)-7-methyl-3h-imidazo[4,5-b]pyridine

Structural Information

Molecular Formula
C8H7BrClN3
SMILES
CC1=C2C(=NC=C1Br)N=C(N2)CCl
InChI
InChI=1S/C8H7BrClN3/c1-4-5(9)3-11-8-7(4)12-6(2-10)13-8/h3H,2H2,1H3,(H,11,12,13)
InChIKey
SERNXZIZRBJJOO-UHFFFAOYSA-N
Compound name
6-bromo-2-(chloromethyl)-7-methyl-1H-imidazo[4,5-b]pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

258.9512 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 259.95848 150.2
[M+Na]+ 281.94042 155.9
[M+NH4]+ 276.98502 155.1
[M+K]+ 297.91436 155.9
[M-H]- 257.94392 149.6
[M+Na-2H]- 279.92587 153.2
[M]+ 258.95065 150.0
[M]- 258.95175 150.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

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No literature data available for this compound.

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No patent data available for this compound.