CID 15588584

1h-imidazo(1,2-a)pyridin-4-ium, 1,1'-hexamethylenebis(2-(p-fluorophenyl)-, diperchlorate

Structural Information

Molecular Formula
C32H30F2N4
SMILES
C1=CC=[N+]2C=C(N(C2=C1)CCCCCCN3C4=CC=CC=[N+]4C=C3C5=CC=C(C=C5)F)C6=CC=C(C=C6)F
InChI
InChI=1S/C32H30F2N4/c33-27-15-11-25(12-16-27)29-23-35-19-7-3-9-31(35)37(29)21-5-1-2-6-22-38-30(26-13-17-28(34)18-14-26)24-36-20-8-4-10-32(36)38/h3-4,7-20,23-24H,1-2,5-6,21-22H2/q+2
InChIKey
ICPUYKZJGQVZHP-UHFFFAOYSA-N
Compound name
2-(4-fluorophenyl)-1-[6-[2-(4-fluorophenyl)imidazo[1,2-a]pyridin-4-ium-1-yl]hexyl]imidazo[1,2-a]pyridin-4-ium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

508.24387 Da
Monoisotopic Mass

8.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 509.25115 237.3
[M+Na]+ 531.23309 245.9
[M-H]- 507.23659 245.1
[M+NH4]+ 526.27769 242.3
[M+K]+ 547.20703 223.9
[M+H-H2O]+ 491.24113 226.0
[M+HCOO]- 553.24207 251.8
[M+CH3COO]- 567.25772 231.6
[M+Na-2H]- 529.21854 239.1
[M]+ 508.24332 238.2
[M]- 508.24442 238.2
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.