CID 176514044

4-hydroxy-n-[(e)-(4-hydroxyphenyl)methyleneamino]-2-oxo-1h-quinoline-3-carboxamide

Structural Information

Molecular Formula
C17H13N3O4
SMILES
C1=CC=C2C(=C1)C(=C(C(=O)N2)C(=O)N/N=C/C3=CC=C(C=C3)O)O
InChI
InChI=1S/C17H13N3O4/c21-11-7-5-10(6-8-11)9-18-20-17(24)14-15(22)12-3-1-2-4-13(12)19-16(14)23/h1-9,21H,(H,20,24)(H2,19,22,23)/b18-9+
InChIKey
HXJLFPFNYBHQAF-GIJQJNRQSA-N
Compound name
4-hydroxy-N-[(E)-(4-hydroxyphenyl)methylideneamino]-2-oxo-1H-quinoline-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

323.0906 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 324.09788 170.9
[M+Na]+ 346.07982 178.7
[M-H]- 322.08332 175.2
[M+NH4]+ 341.12442 182.5
[M+K]+ 362.05376 173.1
[M+H-H2O]+ 306.08786 162.1
[M+HCOO]- 368.08880 191.9
[M+CH3COO]- 382.10445 207.9
[M+Na-2H]- 344.06527 176.9
[M]+ 323.09005 169.6
[M]- 323.09115 169.6
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.