CID 15588597

1h-imidazo(1,2-a)pyridin-4-ium, 1,1'-tetramethylenebis(2-phenyl-, diperchlorate

Structural Information

Molecular Formula
C30H28N4
SMILES
C1=CC=C(C=C1)C2=C[N+]3=CC=CC=C3N2CCCCN4C5=CC=CC=[N+]5C=C4C6=CC=CC=C6
InChI
InChI=1S/C30H28N4/c1-3-13-25(14-4-1)27-23-31-19-9-7-17-29(31)33(27)21-11-12-22-34-28(26-15-5-2-6-16-26)24-32-20-10-8-18-30(32)34/h1-10,13-20,23-24H,11-12,21-22H2/q+2
InChIKey
QSEZZQXCSQLXDB-UHFFFAOYSA-N
Compound name
2-phenyl-1-[4-(2-phenylimidazo[1,2-a]pyridin-4-ium-1-yl)butyl]imidazo[1,2-a]pyridin-4-ium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

444.23138 Da
Monoisotopic Mass

7.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 445.23866 221.2
[M+Na]+ 467.22060 229.0
[M-H]- 443.22410 231.2
[M+NH4]+ 462.26520 228.4
[M+K]+ 483.19454 208.5
[M+H-H2O]+ 427.22864 211.9
[M+HCOO]- 489.22958 238.5
[M+CH3COO]- 503.24523 228.1
[M+Na-2H]- 465.20605 226.6
[M]+ 444.23083 222.4
[M]- 444.23193 222.4
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

No patent data available for this compound.