CID 54677806

378199-95-2

Structural Information

Molecular Formula
C14H17N3O3
SMILES
CCNCCNC(=O)C1=C(C2=CC=CC=C2NC1=O)O
InChI
InChI=1S/C14H17N3O3/c1-2-15-7-8-16-13(19)11-12(18)9-5-3-4-6-10(9)17-14(11)20/h3-6,15H,2,7-8H2,1H3,(H,16,19)(H2,17,18,20)
InChIKey
NDPWLIDXHIDCEX-UHFFFAOYSA-N
Compound name
N-[2-(ethylamino)ethyl]-4-hydroxy-2-oxo-1H-quinoline-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

275.12698 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 276.13426 162.2
[M+Na]+ 298.11620 172.6
[M+NH4]+ 293.16080 167.9
[M+K]+ 314.09014 167.3
[M-H]- 274.11970 163.1
[M+Na-2H]- 296.10165 166.2
[M]+ 275.12643 163.5
[M]- 275.12753 163.5
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.