CID 37870

Hydantoin, 1-allyl-5-phenyl-

Structural Information

Molecular Formula

C₁₂H₁₂N₂O₂

SMILES

C=CCN1C(C(=O)NC1=O)C2=CC=CC=C2

InChI

InChI=1S/C12H12N2O2/c1-2-8-14-10(11(15)13-12(14)16)9-6-4-3-5-7-9/h2-7,10H,1,8H2,(H,13,15,16)

InChIKey

WHRGIOPIQZBECO-UHFFFAOYSA-N

Compound name

5-phenyl-1-prop-2-enylimidazolidine-2,4-dione

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 216.08987 Da
Monoisotopic Mass: 1.5
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]+	217.097146	147.6
[M+Na]+	239.079088	156.1
[M-H]-	215.082594	150.5
[M+NH4]+	234.123693	164.6
[M+K]+	255.053028	151.4
[M+H-H2O]+	199.087130	140.0
[M+HCOO]-	261.088071	167.4
[M+CH3COO]-	275.103721	184.4
[M+Na-2H]-	237.064536	149.5
[M]+	216.08932142	145.0
[M]-	216.09041858	145.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe