CID 9589522

9-chloro-6h-indolo(2,3-b)quinoxaline-6-acetic acid (1-(4-chlorophenyl)ethylidene)hydrazide

Structural Information

Molecular Formula
C24H17Cl2N5O
SMILES
C/C(=N\NC(=O)CN1C2=C(C=C(C=C2)Cl)C3=NC4=CC=CC=C4N=C31)/C5=CC=C(C=C5)Cl
InChI
InChI=1S/C24H17Cl2N5O/c1-14(15-6-8-16(25)9-7-15)29-30-22(32)13-31-21-11-10-17(26)12-18(21)23-24(31)28-20-5-3-2-4-19(20)27-23/h2-12H,13H2,1H3,(H,30,32)/b29-14+
InChIKey
HAAKBTFYAXTMPJ-IPPBACCNSA-N
Compound name
2-(9-chloroindolo[3,2-b]quinoxalin-6-yl)-N-[(E)-1-(4-chlorophenyl)ethylideneamino]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

461.08102 Da
Monoisotopic Mass

5.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 462.08830 207.1
[M+Na]+ 484.07024 218.7
[M-H]- 460.07374 213.7
[M+NH4]+ 479.11484 217.7
[M+K]+ 500.04418 209.7
[M+H-H2O]+ 444.07828 196.0
[M+HCOO]- 506.07922 218.6
[M+CH3COO]- 520.09487 216.0
[M+Na-2H]- 482.05569 212.2
[M]+ 461.08047 215.7
[M]- 461.08157 215.7
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

No patent data available for this compound.