CID 83904843

3-(2-methoxyethyl)oxetan-3-amine

Structural Information

Molecular Formula

C₆H₁₃NO₂

SMILES

COCCC1(COC1)N

InChI

InChI=1S/C6H13NO2/c1-8-3-2-6(7)4-9-5-6/h2-5,7H2,1H3

InChIKey

IYLZCLBICBGIBF-UHFFFAOYSA-N

Compound name

3-(2-methoxyethyl)oxetan-3-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 4
Patents: 131.09464 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]+	132.101916	125.0
[M+Na]+	154.083858	130.2
[M-H]-	130.087364	128.8
[M+NH4]+	149.128463	140.5
[M+K]+	170.057798	134.6
[M+H-H2O]+	114.091900	115.6
[M+HCOO]-	176.092841	146.9
[M+CH3COO]-	190.108491	176.3
[M+Na-2H]-	152.069306	133.1
[M]+	131.09409142	133.9
[M]-	131.09518858	133.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe