CID 99720

57998-96-6

Structural Information

Molecular Formula

C₁₂H₁₂N₂O₂

SMILES

C1CC2=CC=CC=C2C3(C1)C(=O)NC(=O)N3

InChI

InChI=1S/C12H12N2O2/c15-10-12(14-11(16)13-10)7-3-5-8-4-1-2-6-9(8)12/h1-2,4,6H,3,5,7H2,(H2,13,14,15,16)

InChIKey

OZYWLMZRNIFQPM-UHFFFAOYSA-N

Compound name

spiro[2,3-dihydro-1H-naphthalene-4,5'-imidazolidine]-2',4'-dione

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 14
References: 22
Patents: 216.08987 Da
Monoisotopic Mass: 1.2
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]+	217.09715	149.1
[M+Na]+	239.07909	160.2
[M+NH4]+	234.12369	158.3
[M+K]+	255.05303	154.0
[M-H]-	215.08259	150.0
[M+Na-2H]-	237.06454	154.2
[M]+	216.08932	150.8
[M]-	216.09042	150.8

Literature stripe

literature stripe

Patent stripe

patents stripe