CID 14042758

2-(4-bromophenyl)-6-iodoimidazo[1,2-a]pyridine

Structural Information

Molecular Formula
C13H8BrIN2
SMILES
C1=CC(=CC=C1C2=CN3C=C(C=CC3=N2)I)Br
InChI
InChI=1S/C13H8BrIN2/c14-10-3-1-9(2-4-10)12-8-17-7-11(15)5-6-13(17)16-12/h1-8H
InChIKey
DOUYIPIXURZQRX-UHFFFAOYSA-N
Compound name
2-(4-bromophenyl)-6-iodoimidazo[1,2-a]pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

397.89157 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 398.89885 157.4
[M+Na]+ 420.88079 165.1
[M-H]- 396.88429 158.9
[M+NH4]+ 415.92539 172.6
[M+K]+ 436.85473 158.7
[M+H-H2O]+ 380.88883 152.8
[M+HCOO]- 442.88977 174.3
[M+CH3COO]- 456.90542 168.6
[M+Na-2H]- 418.86624 154.9
[M]+ 397.89102 174.4
[M]- 397.89212 174.4
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