CID 154703385

2306264-82-2

Structural Information

Molecular Formula

C₆H₁₃NO₂

SMILES

CNC1(COC1)COC

InChI

InChI=1S/C6H13NO2/c1-7-6(3-8-2)4-9-5-6/h7H,3-5H2,1-2H3

InChIKey

LIACHTXTAPYATF-UHFFFAOYSA-N

Compound name

3-(methoxymethyl)-N-methyloxetan-3-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 3
Patents: 131.09464 Da
Monoisotopic Mass: -0.8
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]+	132.101916	123.9
[M+Na]+	154.083858	129.2
[M-H]-	130.087364	128.3
[M+NH4]+	149.128463	139.8
[M+K]+	170.057798	133.9
[M+H-H2O]+	114.091900	114.7
[M+HCOO]-	176.092841	146.5
[M+CH3COO]-	190.108491	176.9
[M+Na-2H]-	152.069306	133.2
[M]+	131.09409142	133.9
[M]-	131.09518858	133.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe