CID 91611640

2-amino-octahydroindolizin-3-one hydrochloride

Structural Information

Molecular Formula

C₈H₁₄N₂O

SMILES

C1CCN2C(C1)CC(C2=O)N

InChI

InChI=1S/C8H14N2O/c9-7-5-6-3-1-2-4-10(6)8(7)11/h6-7H,1-5,9H2

InChIKey

CTOCEGHPUJTFQT-UHFFFAOYSA-N

Compound name

2-amino-2,5,6,7,8,8a-hexahydro-1H-indolizin-3-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 4
Patents: 154.11061 Da
Monoisotopic Mass: -0.1
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]+	155.11789	133.0
[M+Na]+	177.09983	141.9
[M+NH4]+	172.14443	141.8
[M+K]+	193.07377	138.3
[M-H]-	153.10333	134.4
[M+Na-2H]-	175.08528	135.7
[M]+	154.11006	134.2
[M]-	154.11116	134.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe