CID 212826

Urea, (p-hydroxyphenethyl)-

Structural Information

Molecular Formula

C₉H₁₂N₂O₂

SMILES

C1=CC(=CC=C1CCNC(=O)N)O

InChI

InChI=1S/C9H12N2O2/c10-9(13)11-6-5-7-1-3-8(12)4-2-7/h1-4,12H,5-6H2,(H3,10,11,13)

InChIKey

OVWBGUZHWGBNJB-UHFFFAOYSA-N

Compound name

2-(4-hydroxyphenyl)ethylurea

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 3
Patents: 180.08987 Da
Monoisotopic Mass: 0.6
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]+	181.09715	138.7
[M+Na]+	203.07909	148.4
[M+NH4]+	198.12369	145.8
[M+K]+	219.05303	143.6
[M-H]-	179.08259	140.4
[M+Na-2H]-	201.06454	144.1
[M]+	180.08932	140.2
[M]-	180.09042	140.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe