CID 54676926

7-hydroxy-n-methyl-5-oxo-2,3-dihydro-1h,5h-pyrido[3,2,1-ij]quinoline-6-carboxamide

Structural Information

Molecular Formula
C14H14N2O3
SMILES
CNC(=O)C1=C(C2=CC=CC3=C2N(C1=O)CCC3)O
InChI
InChI=1S/C14H14N2O3/c1-15-13(18)10-12(17)9-6-2-4-8-5-3-7-16(11(8)9)14(10)19/h2,4,6,17H,3,5,7H2,1H3,(H,15,18)
InChIKey
MEKHLDSDOLTVFE-UHFFFAOYSA-N
Compound name
4-hydroxy-N-methyl-2-oxo-1-azatricyclo[7.3.1.05,13]trideca-3,5,7,9(13)-tetraene-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

8
References

0
Patents

258.10043 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 259.107706 155.5
[M+Na]+ 281.089648 163.8
[M-H]- 257.093154 157.8
[M+NH4]+ 276.134253 172.6
[M+K]+ 297.063588 159.8
[M+H-H2O]+ 241.097690 148.3
[M+HCOO]- 303.098631 173.2
[M+CH3COO]- 317.114281 198.4
[M+Na-2H]- 279.075096 162.0
[M]+ 258.09988142 155.4
[M]- 258.10097858 155.4
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.