CID 4962270

3-amino-5-methyl-5-(2-phenylethyl)imidazolidine-2,4-dione

Structural Information

Molecular Formula

C₁₂H₁₅N₃O₂

SMILES

CC1(C(=O)N(C(=O)N1)N)CCC2=CC=CC=C2

InChI

InChI=1S/C12H15N3O2/c1-12(10(16)15(13)11(17)14-12)8-7-9-5-3-2-4-6-9/h2-6H,7-8,13H2,1H3,(H,14,17)

InChIKey

UIXKYGNLIVLFHM-UHFFFAOYSA-N

Compound name

3-amino-5-methyl-5-(2-phenylethyl)imidazolidine-2,4-dione

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 233.11642 Da
Monoisotopic Mass: 0.9
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]+	234.123696	151.7
[M+Na]+	256.105638	159.9
[M-H]-	232.109144	154.4
[M+NH4]+	251.150243	169.5
[M+K]+	272.079578	155.7
[M+H-H2O]+	216.113680	144.5
[M+HCOO]-	278.114621	171.8
[M+CH3COO]-	292.130271	189.2
[M+Na-2H]-	254.091086	154.4
[M]+	233.11587142	148.4
[M]-	233.11696858	148.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe