CID 92616

6-nitro-2-phenylquinolin-4-ol

Structural Information

Molecular Formula
C15H10N2O3
SMILES
C1=CC=C(C=C1)C2=CC(=O)C3=C(N2)C=CC(=C3)[N+](=O)[O-]
InChI
InChI=1S/C15H10N2O3/c18-15-9-14(10-4-2-1-3-5-10)16-13-7-6-11(17(19)20)8-12(13)15/h1-9H,(H,16,18)
InChIKey
KFCTXLVNHOGMHX-UHFFFAOYSA-N
Compound name
6-nitro-2-phenyl-1H-quinolin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

45
Patents

266.06915 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 267.076426 155.7
[M+Na]+ 289.058368 163.8
[M-H]- 265.061874 161.2
[M+NH4]+ 284.102973 170.0
[M+K]+ 305.032308 154.3
[M+H-H2O]+ 249.066410 151.8
[M+HCOO]- 311.067351 178.0
[M+CH3COO]- 325.083001 189.0
[M+Na-2H]- 287.043816 165.2
[M]+ 266.06860142 153.2
[M]- 266.06969858 153.2
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