CID 137976

2,4-dimethoxypyrimidine

Structural Information

Molecular Formula

C₆H₈N₂O₂

SMILES

COC1=NC(=NC=C1)OC

InChI

InChI=1S/C6H8N2O2/c1-9-5-3-4-7-6(8-5)10-2/h3-4H,1-2H3

InChIKey

KEVRHVMWBKFGLO-UHFFFAOYSA-N

Compound name

2,4-dimethoxypyrimidine

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 6
References: 1322
Patents: 140.05858 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]+	141.06586	125.8
[M+Na]+	163.04780	139.4
[M+NH4]+	158.09240	133.7
[M+K]+	179.02174	133.7
[M-H]-	139.05130	126.6
[M+Na-2H]-	161.03325	133.3
[M]+	140.05803	127.9
[M]-	140.05913	127.9

Literature stripe

literature stripe

Patent stripe

patents stripe