CID 63824

69557-32-0

Structural Information

Molecular Formula
C14H13N3O3
SMILES
CC1=NC2=CC=CC=C2C(=O)N1C3CCC(=O)NC3=O
InChI
InChI=1S/C14H13N3O3/c1-8-15-10-5-3-2-4-9(10)14(20)17(8)11-6-7-12(18)16-13(11)19/h2-5,11H,6-7H2,1H3,(H,16,18,19)
InChIKey
RKAGXGJVJCKBPG-UHFFFAOYSA-N
Compound name
3-(2-methyl-4-oxoquinazolin-3-yl)piperidine-2,6-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

178
Patents

271.0957 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 272.10298 161.7
[M+Na]+ 294.08492 176.1
[M+NH4]+ 289.12952 168.0
[M+K]+ 310.05886 169.8
[M-H]- 270.08842 163.4
[M+Na-2H]- 292.07037 167.2
[M]+ 271.09515 164.0
[M]- 271.09625 164.0
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

patents stripe