CID 336450

5-(propan-2-ylidene)imidazolidine-2,4-dione

Structural Information

Molecular Formula

C₆H₈N₂O₂

SMILES

CC(=C1C(=O)NC(=O)N1)C

InChI

InChI=1S/C6H8N2O2/c1-3(2)4-5(9)8-6(10)7-4/h1-2H3,(H2,7,8,9,10)

InChIKey

GHKHZJHMIBYCPG-UHFFFAOYSA-N

Compound name

5-propan-2-ylideneimidazolidine-2,4-dione

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 55
Patents: 140.05858 Da
Monoisotopic Mass: 0.4
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]+	141.065856	129.3
[M+Na]+	163.047798	137.5
[M-H]-	139.051304	127.7
[M+NH4]+	158.092403	148.7
[M+K]+	179.021738	134.7
[M+H-H2O]+	123.055840	123.6
[M+HCOO]-	185.056781	147.0
[M+CH3COO]-	199.072431	167.2
[M+Na-2H]-	161.033246	130.9
[M]+	140.05803142	123.9
[M]-	140.05912858	123.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe