CID 478701

Chembl290269

Structural Information

Molecular Formula
C18H17N3O3
SMILES
CCN1C=C(C(=O)C2=C1C=C(C=C2)C3=CC=NC=C3)C(=O)N(C)O
InChI
InChI=1S/C18H17N3O3/c1-3-21-11-15(18(23)20(2)24)17(22)14-5-4-13(10-16(14)21)12-6-8-19-9-7-12/h4-11,24H,3H2,1-2H3
InChIKey
FNFSVALNIIFHCV-UHFFFAOYSA-N
Compound name
1-ethyl-N-hydroxy-N-methyl-4-oxo-7-pyridin-4-ylquinoline-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

323.12698 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 324.13426 175.0
[M+Na]+ 346.11620 183.6
[M-H]- 322.11970 180.5
[M+NH4]+ 341.16080 187.1
[M+K]+ 362.09014 179.4
[M+H-H2O]+ 306.12424 165.1
[M+HCOO]- 368.12518 194.9
[M+CH3COO]- 382.14083 212.7
[M+Na-2H]- 344.10165 179.5
[M]+ 323.12643 177.5
[M]- 323.12753 177.5
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

No patent data available for this compound.