CID 105432435

2503208-62-4

Structural Information

Molecular Formula

C₉H₁₂N₂O

SMILES

C1CCN2C(=CC=C(C2=O)N)C1

InChI

InChI=1S/C9H12N2O/c10-8-5-4-7-3-1-2-6-11(7)9(8)12/h4-5H,1-3,6,10H2

InChIKey

FLNAWLXBSLKTGB-UHFFFAOYSA-N

Compound name

3-amino-6,7,8,9-tetrahydroquinolizin-4-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 164.09496 Da
Monoisotopic Mass: 0.7
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]+	165.10224	132.5
[M+Na]+	187.08418	145.2
[M+NH4]+	182.12878	141.6
[M+K]+	203.05812	138.6
[M-H]-	163.08768	135.3
[M+Na-2H]-	185.06963	138.8
[M]+	164.09441	134.9
[M]-	164.09551	134.9

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.