CID 13125506

5-hydroxy-4,6-dimethylpyrimidin-2(1h)-one

Structural Information

Molecular Formula

C₆H₈N₂O₂

SMILES

CC1=C(C(=NC(=O)N1)C)O

InChI

InChI=1S/C6H8N2O2/c1-3-5(9)4(2)8-6(10)7-3/h9H,1-2H3,(H,7,8,10)

InChIKey

SUWXIVHXWFFNRI-UHFFFAOYSA-N

Compound name

5-hydroxy-4,6-dimethyl-1H-pyrimidin-2-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 11
Patents: 140.05858 Da
Monoisotopic Mass: -0.2
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]+	141.06586	126.4
[M+Na]+	163.04780	139.6
[M+NH4]+	158.09240	133.3
[M+K]+	179.02174	134.9
[M-H]-	139.05130	126.0
[M+Na-2H]-	161.03325	132.0
[M]+	140.05803	128.0
[M]-	140.05913	128.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe