CID 68839174

2416243-49-5

Structural Information

Molecular Formula

C₁₀H₂₀N₂O

SMILES

CN(C)CCC(=O)N1CCCCC1

InChI

InChI=1S/C10H20N2O/c1-11(2)9-6-10(13)12-7-4-3-5-8-12/h3-9H2,1-2H3

InChIKey

RQTXIRLKGQYDFE-UHFFFAOYSA-N

Compound name

3-(dimethylamino)-1-piperidin-1-ylpropan-1-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 18
Patents: 184.15756 Da
Monoisotopic Mass: 0.5
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]+	185.16484	144.6
[M+Na]+	207.14678	153.5
[M+NH4]+	202.19138	152.4
[M+K]+	223.12072	148.1
[M-H]-	183.15028	146.1
[M+Na-2H]-	205.13223	148.8
[M]+	184.15701	145.9
[M]-	184.15811	145.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe