CID 135434935

Nsc716810

Structural Information

Molecular Formula
C24H16Cl2N2O2
SMILES
C1=CC=C2N=C(C(=NC2=C1)/C=C(\O)/C3=CC=C(C=C3)Cl)/C=C(\O)/C4=CC=C(C=C4)Cl
InChI
InChI=1S/C24H16Cl2N2O2/c25-17-9-5-15(6-10-17)23(29)13-21-22(28-20-4-2-1-3-19(20)27-21)14-24(30)16-7-11-18(26)12-8-16/h1-14,29-30H/b23-13-,24-14-
InChIKey
BPDWEFPECRYETO-GACBQCINSA-N
Compound name
(Z)-1-(4-chlorophenyl)-2-[3-[(Z)-2-(4-chlorophenyl)-2-hydroxyethenyl]quinoxalin-2-yl]ethenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

434.05887 Da
Monoisotopic Mass

5.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 435.06615 198.4
[M+Na]+ 457.04809 206.8
[M-H]- 433.05159 202.6
[M+NH4]+ 452.09269 205.7
[M+K]+ 473.02203 196.6
[M+H-H2O]+ 417.05613 188.4
[M+HCOO]- 479.05707 203.7
[M+CH3COO]- 493.07272 205.7
[M+Na-2H]- 455.03354 199.8
[M]+ 434.05832 199.9
[M]- 434.05942 199.9
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.