CID 166411

73287-55-5

Structural Information

Molecular Formula
C23H19BrN2O4
SMILES
CCN(CC)C(=O)C1=CC2=C(C=C1)C(=O)C(C2=O)C3=NC4=CC=CC=C4C(=C3O)Br
InChI
InChI=1S/C23H19BrN2O4/c1-3-26(4-2)23(30)12-9-10-13-15(11-12)21(28)17(20(13)27)19-22(29)18(24)14-7-5-6-8-16(14)25-19/h5-11,17,29H,3-4H2,1-2H3
InChIKey
BUFKXMCKNWZUMN-UHFFFAOYSA-N
Compound name
2-(4-bromo-3-hydroxyquinolin-2-yl)-N,N-diethyl-1,3-dioxoindene-5-carboxamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

466.05283 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 467.06011 201.5
[M+Na]+ 489.04205 204.9
[M+NH4]+ 484.08665 204.3
[M+K]+ 505.01599 205.8
[M-H]- 465.04555 203.2
[M+Na-2H]- 487.02750 202.0
[M]+ 466.05228 201.2
[M]- 466.05338 201.2
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.