CID 24997596

2-(aziridin-2-yl)-3-oxa-1-azabicyclo(3.1.0)hexan-4-ol

Structural Information

Molecular Formula

C₆H₁₀N₂O₂

SMILES

C1C(N1)C2N3CC3C(O2)O

InChI

InChI=1S/C6H10N2O2/c9-6-4-2-8(4)5(10-6)3-1-7-3/h3-7,9H,1-2H2

InChIKey

WLKQLTSLRNRVSR-UHFFFAOYSA-N

Compound name

2-(aziridin-2-yl)-3-oxa-1-azabicyclo[3.1.0]hexan-4-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 5
Patents: 142.07423 Da
Monoisotopic Mass: -1.2
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]+	143.08151	116.1
[M+Na]+	165.06345	127.7
[M+NH4]+	160.10805	124.3
[M+K]+	181.03739	129.2
[M-H]-	141.06695	129.6
[M+Na-2H]-	163.04890	124.7
[M]+	142.07368	123.3
[M]-	142.07478	123.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe