CID 66545109

8-(benzyloxy)-3-chloroimidazo[1,2-a]pyridine

Structural Information

Molecular Formula
C14H11ClN2O
SMILES
C1=CC=C(C=C1)COC2=CC=CN3C2=NC=C3Cl
InChI
InChI=1S/C14H11ClN2O/c15-13-9-16-14-12(7-4-8-17(13)14)18-10-11-5-2-1-3-6-11/h1-9H,10H2
InChIKey
FRVRMNWDDJGQTH-UHFFFAOYSA-N
Compound name
3-chloro-8-phenylmethoxyimidazo[1,2-a]pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

258.056 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 259.063276 154.8
[M+Na]+ 281.045218 166.4
[M-H]- 257.048724 160.2
[M+NH4]+ 276.089823 172.7
[M+K]+ 297.019158 160.2
[M+H-H2O]+ 241.053260 146.4
[M+HCOO]- 303.054201 173.9
[M+CH3COO]- 317.069851 168.0
[M+Na-2H]- 279.030666 162.0
[M]+ 258.05545142 160.0
[M]- 258.05654858 160.0
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.