CID 3087761

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

Structural Information

Molecular Formula
C15H12N2O
SMILES
CC1=CC2=C(N=CC=C2)N(C1=O)C3=CC=CC=C3
InChI
InChI=1S/C15H12N2O/c1-11-10-12-6-5-9-16-14(12)17(15(11)18)13-7-3-2-4-8-13/h2-10H,1H3
InChIKey
GCEGMROSUYCLTO-UHFFFAOYSA-N
Compound name
3-methyl-1-phenyl-1,8-naphthyridin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
Patents

236.09496 Da
Monoisotopic Mass

2.7
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

No literature data available for this compound.

Patent stripe

patents stripe