CID 3163331

883106-47-6

Structural Information

Molecular Formula

C₉H₁₆N₂O

SMILES

C1CC1C(=O)N2CCC(CC2)N

InChI

InChI=1S/C9H16N2O/c10-8-3-5-11(6-4-8)9(12)7-1-2-7/h7-8H,1-6,10H2

InChIKey

GCYSQXZPDQBVCH-UHFFFAOYSA-N

Compound name

(4-aminopiperidin-1-yl)-cyclopropylmethanone

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 3
References: 58
Patents: 168.12627 Da
Monoisotopic Mass: -0.2
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]+	169.13355	138.3
[M+Na]+	191.11549	149.1
[M+NH4]+	186.16009	147.0
[M+K]+	207.08943	145.5
[M-H]-	167.11899	147.7
[M+Na-2H]-	189.10094	145.8
[M]+	168.12572	143.3
[M]-	168.12682	143.3

Literature stripe

literature stripe

Patent stripe

patents stripe