CID 273910

Nsc119603

Structural Information

Molecular Formula
C18H15NO2
SMILES
CC(=O)C1=CC(=NC2=C1C=C(C=C2)OC)C3=CC=CC=C3
InChI
InChI=1S/C18H15NO2/c1-12(20)15-11-18(13-6-4-3-5-7-13)19-17-9-8-14(21-2)10-16(15)17/h3-11H,1-2H3
InChIKey
QFXFVSPKXKQCCQ-UHFFFAOYSA-N
Compound name
1-(6-methoxy-2-phenylquinolin-4-yl)ethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

277.1103 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 278.11758 163.6
[M+Na]+ 300.09952 172.5
[M-H]- 276.10302 170.2
[M+NH4]+ 295.14412 179.3
[M+K]+ 316.07346 167.8
[M+H-H2O]+ 260.10756 154.7
[M+HCOO]- 322.10850 184.6
[M+CH3COO]- 336.12415 175.7
[M+Na-2H]- 298.08497 169.4
[M]+ 277.10975 165.9
[M]- 277.11085 165.9
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.