CID 122155795

7-bromo-1-methyl-2-(trifluoromethyl)-1h-imidazo[4,5-c]pyridine

Structural Information

Molecular Formula
C8H5BrF3N3
SMILES
CN1C2=C(C=NC=C2N=C1C(F)(F)F)Br
InChI
InChI=1S/C8H5BrF3N3/c1-15-6-4(9)2-13-3-5(6)14-7(15)8(10,11)12/h2-3H,1H3
InChIKey
AGBHYKWVDNCYPS-UHFFFAOYSA-N
Compound name
7-bromo-1-methyl-2-(trifluoromethyl)imidazo[4,5-c]pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

278.96188 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 279.96916 150.9
[M+Na]+ 301.95110 167.4
[M-H]- 277.95460 152.1
[M+NH4]+ 296.99570 170.5
[M+K]+ 317.92504 155.2
[M+H-H2O]+ 261.95914 148.2
[M+HCOO]- 323.96008 167.1
[M+CH3COO]- 337.97573 194.7
[M+Na-2H]- 299.93655 158.4
[M]+ 278.96133 168.8
[M]- 278.96243 168.8
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

No patent data available for this compound.