CID 72208306

8-hydroxy-6-oxa-3-azabicyclo[3.2.1]octane

Structural Information

Molecular Formula

C₆H₁₁NO₂

SMILES

C1C2COC(C2O)CN1

InChI

InChI=1S/C6H11NO2/c8-6-4-1-7-2-5(6)9-3-4/h4-8H,1-3H2

InChIKey

TWEISKJFQUHRBG-UHFFFAOYSA-N

Compound name

6-oxa-3-azabicyclo[3.2.1]octan-8-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 129.07898 Da
Monoisotopic Mass: -1.1
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]+	130.086256	124.5
[M+Na]+	152.068198	130.9
[M-H]-	128.071704	123.6
[M+NH4]+	147.112803	146.0
[M+K]+	168.042138	129.9
[M+H-H2O]+	112.076240	119.8
[M+HCOO]-	174.077181	139.9
[M+CH3COO]-	188.092831	137.0
[M+Na-2H]-	150.053646	131.2
[M]+	129.07843142	119.8
[M]-	129.07952858	119.8

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.