CID 2761142

849924-99-8

Structural Information

Molecular Formula

C₁₁H₁₇N₃O₂

SMILES

COC1=CC(=NC(=N1)C2CCNCC2)OC

InChI

InChI=1S/C11H17N3O2/c1-15-9-7-10(16-2)14-11(13-9)8-3-5-12-6-4-8/h7-8,12H,3-6H2,1-2H3

InChIKey

KLBDSBXBSWXRQE-UHFFFAOYSA-N

Compound name

4,6-dimethoxy-2-piperidin-4-ylpyrimidine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 21
Patents: 223.13208 Da
Monoisotopic Mass: 1.0
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]+	224.13936	152.0
[M+Na]+	246.12130	164.3
[M+NH4]+	241.16590	158.8
[M+K]+	262.09524	158.3
[M-H]-	222.12480	153.6
[M+Na-2H]-	244.10675	158.3
[M]+	223.13153	153.9
[M]-	223.13263	153.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe