CID 3073333

1-methyl-3-phenyl-1,8-naphthyridin-2(1h)-one

Structural Information

Molecular Formula
C15H12N2O
SMILES
CN1C2=C(C=CC=N2)C=C(C1=O)C3=CC=CC=C3
InChI
InChI=1S/C15H12N2O/c1-17-14-12(8-5-9-16-14)10-13(15(17)18)11-6-3-2-4-7-11/h2-10H,1H3
InChIKey
XJMXZQVIWNNCRV-UHFFFAOYSA-N
Compound name
1-methyl-3-phenyl-1,8-naphthyridin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

236.09496 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 237.10224 152.1
[M+Na]+ 259.08418 162.8
[M-H]- 235.08768 157.6
[M+NH4]+ 254.12878 168.3
[M+K]+ 275.05812 157.3
[M+H-H2O]+ 219.09222 142.9
[M+HCOO]- 281.09316 173.5
[M+CH3COO]- 295.10881 165.0
[M+Na-2H]- 257.06963 160.6
[M]+ 236.09441 153.0
[M]- 236.09551 153.0
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