CID 22632

Meturin

Structural Information

Molecular Formula

C₈H₁₀N₂O₂

SMILES

CNC(=O)N(C1=CC=CC=C1)O

InChI

InChI=1S/C8H10N2O2/c1-9-8(11)10(12)7-5-3-2-4-6-7/h2-6,12H,1H3,(H,9,11)

InChIKey

HLXRWUNSSVKCJL-UHFFFAOYSA-N

Compound name

1-hydroxy-3-methyl-1-phenylurea

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 6
References: 14
Patents: 166.07423 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]+	167.08151	134.6
[M+Na]+	189.06345	144.6
[M+NH4]+	184.10805	142.3
[M+K]+	205.03739	140.1
[M-H]-	165.06695	136.8
[M+Na-2H]-	187.04890	141.2
[M]+	166.07368	136.3
[M]-	166.07478	136.3

Literature stripe

literature stripe

Patent stripe

patents stripe