CID 135483718

Chembl541193

Structural Information

Molecular Formula
C17H15N3O2
SMILES
COC1=CC2=NC=CC(=C2C=C1)N/N=C/C3=CC=C(C=C3)O
InChI
InChI=1S/C17H15N3O2/c1-22-14-6-7-15-16(8-9-18-17(15)10-14)20-19-11-12-2-4-13(21)5-3-12/h2-11,21H,1H3,(H,18,20)/b19-11+
InChIKey
URIYEAGAUYKOIT-YBFXNURJSA-N
Compound name
4-[(E)-[(7-methoxyquinolin-4-yl)hydrazinylidene]methyl]phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

293.11642 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 294.123696 165.6
[M+Na]+ 316.105638 173.5
[M-H]- 292.109144 172.1
[M+NH4]+ 311.150243 180.0
[M+K]+ 332.079578 168.5
[M+H-H2O]+ 276.113680 156.1
[M+HCOO]- 338.114621 190.0
[M+CH3COO]- 352.130271 177.1
[M+Na-2H]- 314.091086 174.2
[M]+ 293.11587142 166.8
[M]- 293.11696858 166.8
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.