CID 62590206

1-(4-aminopiperidin-1-yl)-3-methoxypropan-1-one

Structural Information

Molecular Formula

C₉H₁₈N₂O₂

SMILES

COCCC(=O)N1CCC(CC1)N

InChI

InChI=1S/C9H18N2O2/c1-13-7-4-9(12)11-5-2-8(10)3-6-11/h8H,2-7,10H2,1H3

InChIKey

UQLJENSAJMUUJW-UHFFFAOYSA-N

Compound name

1-(4-aminopiperidin-1-yl)-3-methoxypropan-1-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 5
Patents: 186.13683 Da
Monoisotopic Mass: -0.9
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]+	187.14411	143.1
[M+Na]+	209.12605	151.6
[M+NH4]+	204.17065	150.0
[M+K]+	225.09999	146.9
[M-H]-	185.12955	143.6
[M+Na-2H]-	207.11150	146.2
[M]+	186.13628	144.0
[M]-	186.13738	144.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe