CID 68267284

2-[3-(propan-2-yloxy)azetidin-1-yl]ethan-1-ol

Structural Information

Molecular Formula

C₈H₁₇NO₂

SMILES

CC(C)OC1CN(C1)CCO

InChI

InChI=1S/C8H17NO2/c1-7(2)11-8-5-9(6-8)3-4-10/h7-8,10H,3-6H2,1-2H3

InChIKey

PLQOJZVNALVUQS-UHFFFAOYSA-N

Compound name

2-(3-propan-2-yloxyazetidin-1-yl)ethanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 4
Patents: 159.12593 Da
Monoisotopic Mass: 0.1
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]+	160.13321	136.5
[M+Na]+	182.11515	141.5
[M+NH4]+	177.15975	139.7
[M+K]+	198.08909	139.0
[M-H]-	158.11865	133.3
[M+Na-2H]-	180.10060	137.2
[M]+	159.12538	134.8
[M]-	159.12648	134.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe