CID 89087

21889-27-0

Structural Information

Molecular Formula
C24H18ClN3O3
SMILES
COC1=CC=CC=C1NC(=O)C2=CC3=CC=CC=C3C(=C2O)N=NC4=CC(=CC=C4)Cl
InChI
InChI=1S/C24H18ClN3O3/c1-31-21-12-5-4-11-20(21)26-24(30)19-13-15-7-2-3-10-18(15)22(23(19)29)28-27-17-9-6-8-16(25)14-17/h2-14,29H,1H3,(H,26,30)
InChIKey
KJDVTHBTAGHDAM-UHFFFAOYSA-N
Compound name
4-[(3-chlorophenyl)diazenyl]-3-hydroxy-N-(2-methoxyphenyl)naphthalene-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

18
Patents

431.10367 Da
Monoisotopic Mass

6.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 432.11095 203.6
[M+Na]+ 454.09289 220.1
[M+NH4]+ 449.13749 211.6
[M+K]+ 470.06683 209.8
[M-H]- 430.09639 212.8
[M+Na-2H]- 452.07834 214.5
[M]+ 431.10312 209.0
[M]- 431.10422 209.0
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