CID 54684058

1-butyl-4-hydroxy-2-oxo-n-phenyl-1,2-dihydroquinoline-3-carboxamide

Structural Information

Molecular Formula
C20H20N2O3
SMILES
CCCCN1C2=CC=CC=C2C(=C(C1=O)C(=O)NC3=CC=CC=C3)O
InChI
InChI=1S/C20H20N2O3/c1-2-3-13-22-16-12-8-7-11-15(16)18(23)17(20(22)25)19(24)21-14-9-5-4-6-10-14/h4-12,23H,2-3,13H2,1H3,(H,21,24)
InChIKey
OSTYNJWCELHMRP-UHFFFAOYSA-N
Compound name
1-butyl-4-hydroxy-2-oxo-N-phenylquinoline-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

7
References

0
Patents

336.1474 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 337.154676 179.5
[M+Na]+ 359.136618 187.1
[M-H]- 335.140124 184.6
[M+NH4]+ 354.181223 191.8
[M+K]+ 375.110558 181.4
[M+H-H2O]+ 319.144660 170.2
[M+HCOO]- 381.145601 199.6
[M+CH3COO]- 395.161251 212.6
[M+Na-2H]- 357.122066 183.6
[M]+ 336.14685142 181.0
[M]- 336.14794858 181.0
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.