CID 208417

32092-29-8

Structural Information

Molecular Formula

C₉H₁₂N₂O

SMILES

CC1CCCC2=NC=CC(=O)N12

InChI

InChI=1S/C9H12N2O/c1-7-3-2-4-8-10-6-5-9(12)11(7)8/h5-7H,2-4H2,1H3

InChIKey

HCJOGZBBWGQKGC-UHFFFAOYSA-N

Compound name

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

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 17
Patents: 164.09496 Da
Monoisotopic Mass: 0.4
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]+	165.102236	132.9
[M+Na]+	187.084178	141.9
[M-H]-	163.087684	134.7
[M+NH4]+	182.128783	152.2
[M+K]+	203.058118	139.2
[M+H-H2O]+	147.092220	125.6
[M+HCOO]-	209.093161	152.2
[M+CH3COO]-	223.108811	178.3
[M+Na-2H]-	185.069626	140.9
[M]+	164.09441142	131.2
[M]-	164.09550858	131.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe