CID 11983112

Bisterpy

Structural Information

Molecular Formula
C30H20N6
SMILES
C1=CC=NC(=C1)C2=CC(=CC(=N2)C3=CC=CC=N3)C4=CC(=NC(=C4)C5=CC=CC=N5)C6=CC=CC=N6
InChI
InChI=1S/C30H20N6/c1-5-13-31-23(9-1)27-17-21(18-28(35-27)24-10-2-6-14-32-24)22-19-29(25-11-3-7-15-33-25)36-30(20-22)26-12-4-8-16-34-26/h1-20H
InChIKey
MJIFJDSQZXDTOT-UHFFFAOYSA-N
Compound name
4-(2,6-dipyridin-2-ylpyridin-4-yl)-2,6-dipyridin-2-ylpyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

46
Patents

464.17496 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 465.18224 216.6
[M+Na]+ 487.16418 239.8
[M+NH4]+ 482.20878 223.5
[M+K]+ 503.13812 227.3
[M-H]- 463.16768 227.9
[M+Na-2H]- 485.14963 234.8
[M]+ 464.17441 223.7
[M]- 464.17551 223.7
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