CID 115669758

4-(oxetan-3-yloxy)piperidine hydrochloride

Structural Information

Molecular Formula

C₈H₁₅NO₂

SMILES

C1CNCCC1OC2COC2

InChI

InChI=1S/C8H15NO2/c1-3-9-4-2-7(1)11-8-5-10-6-8/h7-9H,1-6H2

InChIKey

BFBIBLSEDLJLRE-UHFFFAOYSA-N

Compound name

4-(oxetan-3-yloxy)piperidine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 9
Patents: 157.11028 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]+	158.117556	127.1
[M+Na]+	180.099498	129.8
[M-H]-	156.103004	130.3
[M+NH4]+	175.144103	137.7
[M+K]+	196.073438	133.1
[M+H-H2O]+	140.107540	115.3
[M+HCOO]-	202.108481	142.9
[M+CH3COO]-	216.124131	175.3
[M+Na-2H]-	178.084946	133.4
[M]+	157.10973142	130.4
[M]-	157.11082858	130.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe