CID 44145958

72138-94-4

Structural Information

Molecular Formula
C24H23N3O4
SMILES
CN(C)CCCNC(=O)C1=CC2=C(C=C1)C(=O)C(C2=O)C3=NC4=CC=CC=C4C=C3O
InChI
InChI=1S/C24H23N3O4/c1-27(2)11-5-10-25-24(31)15-8-9-16-17(12-15)23(30)20(22(16)29)21-19(28)13-14-6-3-4-7-18(14)26-21/h3-4,6-9,12-13,20,28H,5,10-11H2,1-2H3,(H,25,31)
InChIKey
ZNFJANAJDBMAAV-UHFFFAOYSA-N
Compound name
N-[3-(dimethylamino)propyl]-2-(3-hydroxyquinolin-2-yl)-1,3-dioxoindene-5-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

417.16885 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 418.17613 199.5
[M+Na]+ 440.15807 206.1
[M-H]- 416.16157 206.9
[M+NH4]+ 435.20267 211.5
[M+K]+ 456.13201 201.4
[M+H-H2O]+ 400.16611 190.3
[M+HCOO]- 462.16705 218.9
[M+CH3COO]- 476.18270 234.9
[M+Na-2H]- 438.14352 199.7
[M]+ 417.16830 202.5
[M]- 417.16940 202.5
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.