CID 68294747

7-bromo-2-(trifluoromethyl)imidazo[1,2-a]pyridine

Structural Information

Molecular Formula
C8H4BrF3N2
SMILES
C1=CN2C=C(N=C2C=C1Br)C(F)(F)F
InChI
InChI=1S/C8H4BrF3N2/c9-5-1-2-14-4-6(8(10,11)12)13-7(14)3-5/h1-4H
InChIKey
YYTBJGAADACPQG-UHFFFAOYSA-N
Compound name
7-bromo-2-(trifluoromethyl)imidazo[1,2-a]pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

19
Patents

263.951 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 264.958276 147.6
[M+Na]+ 286.940218 163.4
[M-H]- 262.943724 149.8
[M+NH4]+ 281.984823 168.8
[M+K]+ 302.914158 151.3
[M+H-H2O]+ 246.948260 145.5
[M+HCOO]- 308.949201 165.1
[M+CH3COO]- 322.964851 191.0
[M+Na-2H]- 284.925666 155.8
[M]+ 263.95045142 164.7
[M]- 263.95154858 164.7
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