CID 44541206

1194473-21-6

Structural Information

Molecular Formula

C₁₀H₁₀N₂O₂

SMILES

C1=CC=C(C=C1)CN2C=CN(C2=O)O

InChI

InChI=1S/C10H10N2O2/c13-10-11(6-7-12(10)14)8-9-4-2-1-3-5-9/h1-7,14H,8H2

InChIKey

KEOZDNMCRGLMHT-UHFFFAOYSA-N

Compound name

1-benzyl-3-hydroxyimidazol-2-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 2
References: 4
Patents: 190.07423 Da
Monoisotopic Mass: 0.5
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]+	191.08151	139.5
[M+Na]+	213.06345	153.0
[M+NH4]+	208.10805	147.0
[M+K]+	229.03739	148.7
[M-H]-	189.06695	141.4
[M+Na-2H]-	211.04890	147.3
[M]+	190.07368	141.8
[M]-	190.07478	141.8

Literature stripe

literature stripe

Patent stripe

patents stripe