CID 22257895

3-(piperidin-3-yl)propanamide

Structural Information

Molecular Formula

C₈H₁₆N₂O

SMILES

C1CC(CNC1)CCC(=O)N

InChI

InChI=1S/C8H16N2O/c9-8(11)4-3-7-2-1-5-10-6-7/h7,10H,1-6H2,(H2,9,11)

InChIKey

FVGJUODBCPPKLO-UHFFFAOYSA-N

Compound name

3-piperidin-3-ylpropanamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 27
Patents: 156.12627 Da
Monoisotopic Mass: -0.3
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]+	157.13355	136.8
[M+Na]+	179.11549	140.2
[M-H]-	155.11899	135.9
[M+NH4]+	174.16009	154.6
[M+K]+	195.08943	138.2
[M+H-H2O]+	139.12353	130.2
[M+HCOO]-	201.12447	154.3
[M+CH3COO]-	215.14012	175.6
[M+Na-2H]-	177.10094	140.0
[M]+	156.12572	128.9
[M]-	156.12682	128.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe