CID 4685120

3-amino-5-methyl-5-phenylimidazolidine-2,4-dione

Structural Information

Molecular Formula

C₁₀H₁₁N₃O₂

SMILES

CC1(C(=O)N(C(=O)N1)N)C2=CC=CC=C2

InChI

InChI=1S/C10H11N3O2/c1-10(7-5-3-2-4-6-7)8(14)13(11)9(15)12-10/h2-6H,11H2,1H3,(H,12,15)

InChIKey

PTVDNZQYPWTLBQ-UHFFFAOYSA-N

Compound name

3-amino-5-methyl-5-phenylimidazolidine-2,4-dione

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 7
References: 1
Patents: 205.08513 Da
Monoisotopic Mass: 0.3
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]+	206.09241	142.9
[M+Na]+	228.07435	152.1
[M-H]-	204.07785	146.0
[M+NH4]+	223.11895	161.9
[M+K]+	244.04829	148.3
[M+H-H2O]+	188.08239	136.1
[M+HCOO]-	250.08333	163.7
[M+CH3COO]-	264.09898	183.2
[M+Na-2H]-	226.05980	146.7
[M]+	205.08458	139.0
[M]-	205.08568	139.0

Literature stripe

literature stripe

Patent stripe

patents stripe