CID 103284

65151-66-8

Structural Information

Molecular Formula
C23H20N5O2
SMILES
CN1C(=[N+](C2=NC3=CC=CC=C3N=C21)C)C=CC4=C(N(OC4=O)C)C5=CC=CC=C5
InChI
InChI=1S/C23H20N5O2/c1-26-19(27(2)22-21(26)24-17-11-7-8-12-18(17)25-22)14-13-16-20(28(3)30-23(16)29)15-9-5-4-6-10-15/h4-14H,1-3H3/q+1
InChIKey
WGQOYMUUPSYNNS-UHFFFAOYSA-N
Compound name
4-[2-(1,3-dimethylimidazo[4,5-b]quinoxalin-3-ium-2-yl)ethenyl]-2-methyl-3-phenyl-1,2-oxazol-5-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

398.1617 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 399.16898 194.3
[M+Na]+ 421.15092 215.7
[M+NH4]+ 416.19552 201.7
[M+K]+ 437.12486 211.3
[M-H]- 397.15442 201.8
[M+Na-2H]- 419.13637 203.3
[M]+ 398.16115 200.1
[M]- 398.16225 200.1
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.