CID 80855

2-naphthalenecarboxamide, 4-(2-(3-chlorophenyl)diazenyl)-3-hydroxy-n-phenyl-

Structural Information

Molecular Formula
C23H16ClN3O2
SMILES
C1=CC=C(C=C1)NC(=O)C2=CC3=CC=CC=C3C(=C2O)N=NC4=CC(=CC=C4)Cl
InChI
InChI=1S/C23H16ClN3O2/c24-16-8-6-11-18(14-16)26-27-21-19-12-5-4-7-15(19)13-20(22(21)28)23(29)25-17-9-2-1-3-10-17/h1-14,28H,(H,25,29)
InChIKey
MDODOQLFXACXDN-UHFFFAOYSA-N
Compound name
4-[(3-chlorophenyl)diazenyl]-3-hydroxy-N-phenylnaphthalene-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

19
Patents

401.0931 Da
Monoisotopic Mass

6.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 402.10038 194.1
[M+Na]+ 424.08232 201.8
[M-H]- 400.08582 205.7
[M+NH4]+ 419.12692 206.1
[M+K]+ 440.05626 195.0
[M+H-H2O]+ 384.09036 183.9
[M+HCOO]- 446.09130 215.9
[M+CH3COO]- 460.10695 204.3
[M+Na-2H]- 422.06777 200.2
[M]+ 401.09255 197.0
[M]- 401.09365 197.0
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