CID 135404214

6-amino-2-methoxypyrimidin-4-ol

Structural Information

Molecular Formula

C₅H₇N₃O₂

SMILES

COC1=NC(=CC(=O)N1)N

InChI

InChI=1S/C5H7N3O2/c1-10-5-7-3(6)2-4(9)8-5/h2H,1H3,(H3,6,7,8,9)

InChIKey

YRLXSZNYIJKRDL-UHFFFAOYSA-N

Compound name

4-amino-2-methoxy-1H-pyrimidin-6-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 2
References: 40
Patents: 141.05383 Da
Monoisotopic Mass: -0.8
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]+	142.06111	125.2
[M+Na]+	164.04305	137.2
[M+NH4]+	159.08765	131.9
[M+K]+	180.01699	132.9
[M-H]-	140.04655	125.3
[M+Na-2H]-	162.02850	131.1
[M]+	141.05328	126.6
[M]-	141.05438	126.6

Literature stripe

literature stripe

Patent stripe

patents stripe