CID 109046

61050-19-9

Structural Information

Molecular Formula
C27H25N3O5
SMILES
CCOC1=CC=CC=C1N=NC2=C(C(=CC3=CC=CC=C32)C(=O)NC4=C(C=CC(=C4)OC)OC)O
InChI
InChI=1S/C27H25N3O5/c1-4-35-24-12-8-7-11-21(24)29-30-25-19-10-6-5-9-17(19)15-20(26(25)31)27(32)28-22-16-18(33-2)13-14-23(22)34-3/h5-16,31H,4H2,1-3H3,(H,28,32)
InChIKey
XTDTUOZTPVGZNH-UHFFFAOYSA-N
Compound name
N-(2,5-dimethoxyphenyl)-4-[(2-ethoxyphenyl)diazenyl]-3-hydroxynaphthalene-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

471.1794 Da
Monoisotopic Mass

6.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 472.18668 216.4
[M+Na]+ 494.16862 230.6
[M+NH4]+ 489.21322 222.4
[M+K]+ 510.14256 222.0
[M-H]- 470.17212 224.5
[M+Na-2H]- 492.15407 225.4
[M]+ 471.17885 220.7
[M]- 471.17995 220.7
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.