CID 6441515

29329-88-2

Structural Information

Molecular Formula
C30H29N5
SMILES
CCN1C(N(C2=NC3=CC=CC=C3N=C21)CC)/C=C/C4=C(N(C5=CC=CC=C54)C)C6=CC=CC=C6
InChI
InChI=1S/C30H29N5/c1-4-34-27(35(5-2)30-29(34)31-24-16-10-11-17-25(24)32-30)20-19-23-22-15-9-12-18-26(22)33(3)28(23)21-13-7-6-8-14-21/h6-20,27H,4-5H2,1-3H3/b20-19+
InChIKey
GJUMWAFSOPLWOE-FMQUCBEESA-N
Compound name
1,3-diethyl-2-[(E)-2-(1-methyl-2-phenylindol-3-yl)ethenyl]-2H-imidazo[4,5-b]quinoxaline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

459.2423 Da
Monoisotopic Mass

6.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 460.24958 219.5
[M+Na]+ 482.23152 238.2
[M+NH4]+ 477.27612 227.2
[M+K]+ 498.20546 230.2
[M-H]- 458.23502 225.7
[M+Na-2H]- 480.21697 226.6
[M]+ 459.24175 224.3
[M]- 459.24285 224.3
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.