CID 11413127

66698-27-9

Structural Information

Molecular Formula

C₁₁H₁₆N₂O₂

SMILES

CC1=C(C(=O)N2CCCCC2=N1)CCO

InChI

InChI=1S/C11H16N2O2/c1-8-9(5-7-14)11(15)13-6-3-2-4-10(13)12-8/h14H,2-7H2,1H3

InChIKey

ICDWUCZPFCGGIP-UHFFFAOYSA-N

Compound name

3-(2-hydroxyethyl)-2-methyl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 19
Patents: 208.12119 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]+	209.128466	145.9
[M+Na]+	231.110408	154.5
[M-H]-	207.113914	146.3
[M+NH4]+	226.155013	163.0
[M+K]+	247.084348	150.9
[M+H-H2O]+	191.118450	138.6
[M+HCOO]-	253.119391	163.2
[M+CH3COO]-	267.135041	185.1
[M+Na-2H]-	229.095856	151.7
[M]+	208.12064142	145.0
[M]-	208.12173858	145.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe