CID 80684

6358-48-1

Structural Information

Molecular Formula
C25H19Cl2N3O3
SMILES
CCOC1=CC=CC=C1NC(=O)C2=CC3=CC=CC=C3C(=C2O)N=NC4=C(C=CC(=C4)Cl)Cl
InChI
InChI=1S/C25H19Cl2N3O3/c1-2-33-22-10-6-5-9-20(22)28-25(32)18-13-15-7-3-4-8-17(15)23(24(18)31)30-29-21-14-16(26)11-12-19(21)27/h3-14,31H,2H2,1H3,(H,28,32)
InChIKey
UVVPXDIKEOWIMC-UHFFFAOYSA-N
Compound name
4-[(2,5-dichlorophenyl)diazenyl]-N-(2-ethoxyphenyl)-3-hydroxynaphthalene-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

18
Patents

479.08035 Da
Monoisotopic Mass

7.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 480.08763 213.5
[M+Na]+ 502.06957 222.1
[M-H]- 478.07307 224.6
[M+NH4]+ 497.11417 223.3
[M+K]+ 518.04351 215.3
[M+H-H2O]+ 462.07761 203.7
[M+HCOO]- 524.07855 229.7
[M+CH3COO]- 538.09420 222.5
[M+Na-2H]- 500.05502 216.4
[M]+ 479.07980 221.0
[M]- 479.08090 221.0
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

patents stripe