CID 762727

5548-72-1

Structural Information

Molecular Formula
C16H12N2O2
SMILES
C1=CC=C(C(=C1)N=CC2=NC3=C(C=CC=C3O)C=C2)O
InChI
InChI=1S/C16H12N2O2/c19-14-6-2-1-5-13(14)17-10-12-9-8-11-4-3-7-15(20)16(11)18-12/h1-10,19-20H
InChIKey
KIBXJRHVVSRSKE-UHFFFAOYSA-N
Compound name
2-[(2-hydroxyphenyl)iminomethyl]quinolin-8-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

4
References

0
Patents

264.08987 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 265.097146 158.2
[M+Na]+ 287.079088 167.1
[M-H]- 263.082594 163.7
[M+NH4]+ 282.123693 173.5
[M+K]+ 303.053028 161.5
[M+H-H2O]+ 247.087130 149.7
[M+HCOO]- 309.088071 180.5
[M+CH3COO]- 323.103721 170.1
[M+Na-2H]- 285.064536 166.4
[M]+ 264.08932142 157.9
[M]- 264.09041858 157.9
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

No patent data available for this compound.