CID 9589513

116989-96-9

Structural Information

Molecular Formula
C24H19N5O
SMILES
C/C(=N\NC(=O)CN1C2=CC=CC=C2C3=NC4=CC=CC=C4N=C31)/C5=CC=CC=C5
InChI
InChI=1S/C24H19N5O/c1-16(17-9-3-2-4-10-17)27-28-22(30)15-29-21-14-8-5-11-18(21)23-24(29)26-20-13-7-6-12-19(20)25-23/h2-14H,15H2,1H3,(H,28,30)/b27-16+
InChIKey
MKDQHTFSZIKHNG-JVWAILMASA-N
Compound name
2-indolo[3,2-b]quinoxalin-6-yl-N-[(E)-1-phenylethylideneamino]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

393.15897 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 394.166246 192.6
[M+Na]+ 416.148188 201.5
[M-H]- 392.151694 199.9
[M+NH4]+ 411.192793 203.9
[M+K]+ 432.122128 193.9
[M+H-H2O]+ 376.156230 180.7
[M+HCOO]- 438.157171 213.9
[M+CH3COO]- 452.172821 202.2
[M+Na-2H]- 414.133636 200.7
[M]+ 393.15842142 196.3
[M]- 393.15951858 196.3
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.