CID 24967599

Avadomide

Structural Information

Molecular Formula

C₁₄H₁₄N₄O₃

SMILES

CC1=NC2=CC=CC(=C2C(=O)N1C3CCC(=O)NC3=O)N

InChI

InChI=1S/C14H14N4O3/c1-7-16-9-4-2-3-8(15)12(9)14(21)18(7)10-5-6-11(19)17-13(10)20/h2-4,10H,5-6,15H2,1H3,(H,17,19,20)

InChIKey

RSNPAKAFCAAMBH-UHFFFAOYSA-N

Compound name

3-(5-amino-2-methyl-4-oxoquinazolin-3-yl)piperidine-2,6-dione

Related CIDs

2D Structure

compound 2d structure

4
Annotation Hits: 20
References: 1818
Patents: 286.1066 Da
Monoisotopic Mass: 0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	287.11388	167.2
[M+Na]+	309.09582	177.0
[M-H]-	285.09932	169.6
[M+NH4]+	304.14042	178.9
[M+K]+	325.06976	171.0
[M+H-H2O]+	269.10386	157.9
[M+HCOO]-	331.10480	182.8
[M+CH3COO]-	345.12045	202.7
[M+Na-2H]-	307.08127	170.0
[M]+	286.10605	163.4
[M]-	286.10715	163.4

Literature stripe

literature stripe

Patent stripe

patents stripe