CID 57428704

N-(oxan-4-yl)piperidin-4-amine

Structural Information

Molecular Formula

C₁₀H₂₀N₂O

SMILES

C1CNCCC1NC2CCOCC2

InChI

InChI=1S/C10H20N2O/c1-5-11-6-2-9(1)12-10-3-7-13-8-4-10/h9-12H,1-8H2

InChIKey

UDPBJGWBFPNCDC-UHFFFAOYSA-N

Compound name

N-(oxan-4-yl)piperidin-4-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 2
References: 44
Patents: 184.15756 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]+	185.16484	143.4
[M+Na]+	207.14678	144.2
[M-H]-	183.15028	145.8
[M+NH4]+	202.19138	158.5
[M+K]+	223.12072	142.9
[M+H-H2O]+	167.15482	135.4
[M+HCOO]-	229.15576	157.9
[M+CH3COO]-	243.17141	179.1
[M+Na-2H]-	205.13223	148.2
[M]+	184.15701	132.4
[M]-	184.15811	132.4

Literature stripe

literature stripe

Patent stripe

patents stripe