CID 106302

67990-07-2

Structural Information

Molecular Formula
C25H20N4O6
SMILES
COC1=C(C=C(C=C1)[N+](=O)[O-])N=NC2=C(C(=CC3=CC=CC=C32)C(=O)NC4=CC=CC=C4OC)O
InChI
InChI=1S/C25H20N4O6/c1-34-21-10-6-5-9-19(21)26-25(31)18-13-15-7-3-4-8-17(15)23(24(18)30)28-27-20-14-16(29(32)33)11-12-22(20)35-2/h3-14,30H,1-2H3,(H,26,31)
InChIKey
FCYFCQMBEXQZBR-UHFFFAOYSA-N
Compound name
3-hydroxy-4-[(2-methoxy-5-nitrophenyl)diazenyl]-N-(2-methoxyphenyl)naphthalene-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

472.13828 Da
Monoisotopic Mass

5.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 473.14556 211.1
[M+Na]+ 495.12750 225.3
[M+NH4]+ 490.17210 216.7
[M+K]+ 511.10144 220.3
[M-H]- 471.13100 220.1
[M+Na-2H]- 493.11295 219.8
[M]+ 472.13773 215.4
[M]- 472.13883 215.4
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.