CID 9589512

9-chloro-6h-indolo(2,3-b)quinoxaline-6-acetic acid 2-((3,4-dimethoxyphenyl)methylene)hydrazide

Structural Information

Molecular Formula
C25H20ClN5O3
SMILES
COC1=C(C=C(C=C1)/C=N/NC(=O)CN2C3=C(C=C(C=C3)Cl)C4=NC5=CC=CC=C5N=C42)OC
InChI
InChI=1S/C25H20ClN5O3/c1-33-21-10-7-15(11-22(21)34-2)13-27-30-23(32)14-31-20-9-8-16(26)12-17(20)24-25(31)29-19-6-4-3-5-18(19)28-24/h3-13H,14H2,1-2H3,(H,30,32)/b27-13+
InChIKey
FSGQNXHHERUGMJ-UVHMKAGCSA-N
Compound name
2-(9-chloroindolo[3,2-b]quinoxalin-6-yl)-N-[(E)-(3,4-dimethoxyphenyl)methylideneamino]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

473.12546 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 474.13274 212.7
[M+Na]+ 496.11468 224.1
[M-H]- 472.11818 220.4
[M+NH4]+ 491.15928 222.3
[M+K]+ 512.08862 216.6
[M+H-H2O]+ 456.12272 200.8
[M+HCOO]- 518.12366 230.0
[M+CH3COO]- 532.13931 221.9
[M+Na-2H]- 494.10013 218.6
[M]+ 473.12491 223.5
[M]- 473.12601 223.5
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.