CID 23034

6535-46-2

Structural Information

Molecular Formula
C24H16Cl3N3O2
SMILES
CC1=CC=CC=C1NC(=O)C2=CC3=CC=CC=C3C(=C2O)N=NC4=CC(=C(C=C4Cl)Cl)Cl
InChI
InChI=1S/C24H16Cl3N3O2/c1-13-6-2-5-9-20(13)28-24(32)16-10-14-7-3-4-8-15(14)22(23(16)31)30-29-21-12-18(26)17(25)11-19(21)27/h2-12,31H,1H3,(H,28,32)
InChIKey
JQNJCQYNSLCFAC-UHFFFAOYSA-N
Compound name
3-hydroxy-N-(2-methylphenyl)-4-[(2,4,5-trichlorophenyl)diazenyl]naphthalene-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

1
References

1117
Patents

483.03082 Da
Monoisotopic Mass

8.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 484.03810 213.9
[M+Na]+ 506.02004 231.9
[M+NH4]+ 501.06464 222.3
[M+K]+ 521.99398 220.1
[M-H]- 482.02354 222.6
[M+Na-2H]- 504.00549 223.7
[M]+ 483.03027 220.1
[M]- 483.03137 220.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe