CID 79468299

N-methoxy-n-methylazetidin-3-amine dihydrochloride

Structural Information

Molecular Formula

C₅H₁₂N₂O

SMILES

CN(C1CNC1)OC

InChI

InChI=1S/C5H12N2O/c1-7(8-2)5-3-6-4-5/h5-6H,3-4H2,1-2H3

InChIKey

RSXVCRCOQCXBEM-UHFFFAOYSA-N

Compound name

N-methoxy-N-methylazetidin-3-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 116.09496 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]+	117.10224	123.9
[M+Na]+	139.08418	128.5
[M-H]-	115.08768	125.9
[M+NH4]+	134.12878	138.2
[M+K]+	155.05812	132.4
[M+H-H2O]+	99.092220	112.4
[M+HCOO]-	161.09316	145.1
[M+CH3COO]-	175.10881	175.9
[M+Na-2H]-	137.06963	130.0
[M]+	116.09441	131.0
[M]-	116.09551	131.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe