CID 87825

Einecs 242-621-1

Structural Information

Molecular Formula
C24H19N3O3
SMILES
COC1=CC=CC=C1N=NC2=C(C(=CC3=CC=CC=C32)C(=O)NC4=CC=CC=C4)O
InChI
InChI=1S/C24H19N3O3/c1-30-21-14-8-7-13-20(21)26-27-22-18-12-6-5-9-16(18)15-19(23(22)28)24(29)25-17-10-3-2-4-11-17/h2-15,28H,1H3,(H,25,29)
InChIKey
MZOOQEKXDIVGRL-UHFFFAOYSA-N
Compound name
3-hydroxy-4-[(2-methoxyphenyl)diazenyl]-N-phenylnaphthalene-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

0
Patents

397.14264 Da
Monoisotopic Mass

6.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 398.14992 193.3
[M+Na]+ 420.13186 199.3
[M-H]- 396.13536 205.0
[M+NH4]+ 415.17646 204.3
[M+K]+ 436.10580 194.7
[M+H-H2O]+ 380.13990 181.9
[M+HCOO]- 442.14084 219.3
[M+CH3COO]- 456.15649 203.3
[M+Na-2H]- 418.11731 199.6
[M]+ 397.14209 195.0
[M]- 397.14319 195.0
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

No patent data available for this compound.