CID 135705577

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

Structural Information

Molecular Formula
C23H16ClN5O2
SMILES
C1=CC=C2C(=C1)N=C3C4=C(C=CC(=C4)Cl)N(C3=N2)CC(=O)N/N=C/C5=CC=C(C=C5)O
InChI
InChI=1S/C23H16ClN5O2/c24-15-7-10-20-17(11-15)22-23(27-19-4-2-1-3-18(19)26-22)29(20)13-21(31)28-25-12-14-5-8-16(30)9-6-14/h1-12,30H,13H2,(H,28,31)/b25-12+
InChIKey
XQCZRTOHFKJLKP-BRJLIKDPSA-N
Compound name
2-(9-chloroindolo[3,2-b]quinoxalin-6-yl)-N-[(E)-(4-hydroxyphenyl)methylideneamino]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

429.09924 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 430.10652 199.0
[M+Na]+ 452.08846 210.6
[M-H]- 428.09196 205.5
[M+NH4]+ 447.13306 209.7
[M+K]+ 468.06240 201.8
[M+H-H2O]+ 412.09650 188.0
[M+HCOO]- 474.09744 215.7
[M+CH3COO]- 488.11309 208.6
[M+Na-2H]- 450.07391 206.5
[M]+ 429.09869 206.0
[M]- 429.09979 206.0
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.