CID 54693782

2-(2,4-dihydroxyquinolin-3-yl)-n-heptylacetamide

Structural Information

Molecular Formula
C18H24N2O3
SMILES
CCCCCCCNC(=O)CC1=C(C2=CC=CC=C2NC1=O)O
InChI
InChI=1S/C18H24N2O3/c1-2-3-4-5-8-11-19-16(21)12-14-17(22)13-9-6-7-10-15(13)20-18(14)23/h6-7,9-10H,2-5,8,11-12H2,1H3,(H,19,21)(H2,20,22,23)
InChIKey
ZYKNCPDOQKVWEU-UHFFFAOYSA-N
Compound name
N-heptyl-2-(4-hydroxy-2-oxo-1H-quinolin-3-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

316.17868 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 317.18596 176.6
[M+Na]+ 339.16790 187.5
[M+NH4]+ 334.21250 182.2
[M+K]+ 355.14184 180.8
[M-H]- 315.17140 177.2
[M+Na-2H]- 337.15335 179.9
[M]+ 316.17813 178.0
[M]- 316.17923 178.0
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.