CID 23110176

787564-03-8

Structural Information

Molecular Formula

C₆H₁₄N₂

SMILES

CN(C)CC1CCN1

InChI

InChI=1S/C6H14N2/c1-8(2)5-6-3-4-7-6/h6-7H,3-5H2,1-2H3

InChIKey

UCDCTEVWRISNRB-UHFFFAOYSA-N

Compound name

1-(azetidin-2-yl)-N,N-dimethylmethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 13
Patents: 114.1157 Da
Monoisotopic Mass: 0.0
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]+	115.12298	126.1
[M+Na]+	137.10492	130.5
[M-H]-	113.10842	128.0
[M+NH4]+	132.14952	140.6
[M+K]+	153.07886	133.7
[M+H-H2O]+	97.112960	114.8
[M+HCOO]-	159.11390	146.9
[M+CH3COO]-	173.12955	177.0
[M+Na-2H]-	135.09037	131.8
[M]+	114.11515	132.2
[M]-	114.11625	132.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe