CID 213260

25912-19-0

Structural Information

Molecular Formula
C17H12N2O2
SMILES
C1=CC=C(C=C1)C(=O)C=NC2=C3C=CC=NC3=C(C=C2)O
InChI
InChI=1S/C17H12N2O2/c20-15-9-8-14(13-7-4-10-18-17(13)15)19-11-16(21)12-5-2-1-3-6-12/h1-11,20H
InChIKey
XUSHAKDSWYJIME-UHFFFAOYSA-N
Compound name
2-(8-hydroxyquinolin-5-yl)imino-1-phenylethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

276.08987 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 277.097146 161.6
[M+Na]+ 299.079088 169.4
[M-H]- 275.082594 167.9
[M+NH4]+ 294.123693 176.6
[M+K]+ 315.053028 164.3
[M+H-H2O]+ 259.087130 152.5
[M+HCOO]- 321.088071 184.2
[M+CH3COO]- 335.103721 173.3
[M+Na-2H]- 297.064536 169.2
[M]+ 276.08932142 161.7
[M]- 276.09041858 161.7
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.