CID 2761119

392233-82-8

Structural Information

Molecular Formula
C15H15N3O3
SMILES
C1CN(CC2=C1N=C3C=CN=CC3=C2)C(=O)CCC(=O)O
InChI
InChI=1S/C15H15N3O3/c19-14(1-2-15(20)21)18-6-4-13-11(9-18)7-10-8-16-5-3-12(10)17-13/h3,5,7-8H,1-2,4,6,9H2,(H,20,21)
InChIKey
DSNBWMMEKUJJHZ-UHFFFAOYSA-N
Compound name
4-(3,4-dihydro-1H-pyrido[4,3-b][1,6]naphthyridin-2-yl)-4-oxobutanoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

285.11133 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 286.11861 165.2
[M+Na]+ 308.10055 177.5
[M+NH4]+ 303.14515 171.5
[M+K]+ 324.07449 171.8
[M-H]- 284.10405 165.0
[M+Na-2H]- 306.08600 168.8
[M]+ 285.11078 166.6
[M]- 285.11188 166.6
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