CID 215889

1-amino-3-phenyl-2,5-pyrrolidinedione

Structural Information

Molecular Formula

C₁₀H₁₀N₂O₂

SMILES

C1C(C(=O)N(C1=O)N)C2=CC=CC=C2

InChI

InChI=1S/C10H10N2O2/c11-12-9(13)6-8(10(12)14)7-4-2-1-3-5-7/h1-5,8H,6,11H2

InChIKey

QXKSJQUQZKEAAZ-UHFFFAOYSA-N

Compound name

1-amino-3-phenylpyrrolidine-2,5-dione

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 190.07423 Da
Monoisotopic Mass: 0.1
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]+	191.08151	140.4
[M+Na]+	213.06345	151.7
[M+NH4]+	208.10805	148.1
[M+K]+	229.03739	148.0
[M-H]-	189.06695	143.2
[M+Na-2H]-	211.04890	146.4
[M]+	190.07368	142.5
[M]-	190.07478	142.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe