CID 45791159

959239-81-7

Structural Information

Molecular Formula

C₉H₁₈N₂

SMILES

CC1CCCCN1C2CNC2

InChI

InChI=1S/C9H18N2/c1-8-4-2-3-5-11(8)9-6-10-7-9/h8-10H,2-7H2,1H3

InChIKey

NIIXLZXTTXFBNJ-UHFFFAOYSA-N

Compound name

1-(azetidin-3-yl)-2-methylpiperidine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 154.147 Da
Monoisotopic Mass: 1.0
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]+	155.15428	135.7
[M+Na]+	177.13622	141.9
[M+NH4]+	172.18082	140.3
[M+K]+	193.11016	137.7
[M-H]-	153.13972	135.1
[M+Na-2H]-	175.12167	138.6
[M]+	154.14645	135.0
[M]-	154.14755	135.0

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.