CID 13665716

1-methyl-5-phenyl-2,3-dihydro-1h-imidazol-2-one

Structural Information

Molecular Formula

C₁₀H₁₀N₂O

SMILES

CN1C(=CNC1=O)C2=CC=CC=C2

InChI

InChI=1S/C10H10N2O/c1-12-9(7-11-10(12)13)8-5-3-2-4-6-8/h2-7H,1H3,(H,11,13)

InChIKey

ZNQYIJSZNTVZTF-UHFFFAOYSA-N

Compound name

3-methyl-4-phenyl-1H-imidazol-2-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 10
Patents: 174.07932 Da
Monoisotopic Mass: 1.0
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]+	175.086596	134.6
[M+Na]+	197.068538	144.7
[M-H]-	173.072044	138.2
[M+NH4]+	192.113143	153.6
[M+K]+	213.042478	140.7
[M+H-H2O]+	157.076580	127.3
[M+HCOO]-	219.077521	157.5
[M+CH3COO]-	233.093171	148.4
[M+Na-2H]-	195.053986	140.4
[M]+	174.07877142	133.8
[M]-	174.07986858	133.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe