CID 3053158

69557-28-4

Structural Information

Molecular Formula
C24H19N3O3
SMILES
CC1=NC2=CC=CC=C2C(=O)N1C3CCC(=O)N(C3=O)C4=CC=CC5=CC=CC=C54
InChI
InChI=1S/C24H19N3O3/c1-15-25-19-11-5-4-10-18(19)23(29)26(15)21-13-14-22(28)27(24(21)30)20-12-6-8-16-7-2-3-9-17(16)20/h2-12,21H,13-14H2,1H3
InChIKey
IGWQAQUDFYQIOL-UHFFFAOYSA-N
Compound name
3-(2-methyl-4-oxoquinazolin-3-yl)-1-naphthalen-1-ylpiperidine-2,6-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

397.14264 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 398.14992 199.4
[M+Na]+ 420.13186 209.6
[M-H]- 396.13536 206.9
[M+NH4]+ 415.17646 207.5
[M+K]+ 436.10580 201.5
[M+H-H2O]+ 380.13990 185.8
[M+HCOO]- 442.14084 214.1
[M+CH3COO]- 456.15649 208.0
[M+Na-2H]- 418.11731 202.7
[M]+ 397.14209 199.2
[M]- 397.14319 199.2
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.