CID 77803

4154-63-6

Structural Information

Molecular Formula
C24H18N4O5
SMILES
COC1=CC(=C(C=C1)N=NC2=C(C(=CC3=CC=CC=C32)C(=O)NC4=CC=CC=C4)O)[N+](=O)[O-]
InChI
InChI=1S/C24H18N4O5/c1-33-17-11-12-20(21(14-17)28(31)32)26-27-22-18-10-6-5-7-15(18)13-19(23(22)29)24(30)25-16-8-3-2-4-9-16/h2-14,29H,1H3,(H,25,30)
InChIKey
JNRQCXTYTFQXIQ-UHFFFAOYSA-N
Compound name
3-hydroxy-4-[(4-methoxy-2-nitrophenyl)diazenyl]-N-phenylnaphthalene-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

442.12772 Da
Monoisotopic Mass

5.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 443.13500 203.4
[M+Na]+ 465.11694 218.1
[M+NH4]+ 460.16154 209.8
[M+K]+ 481.09088 212.5
[M-H]- 441.12044 212.9
[M+Na-2H]- 463.10239 213.1
[M]+ 442.12717 208.0
[M]- 442.12827 208.0
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.