CID 18187432

947533-98-4

Structural Information

Molecular Formula

SMILES

C1COC2(O1)CNC2

InChI

InChI=1S/C5H9NO2/c1-2-8-5(7-1)3-6-4-5/h6H,1-4H2

InChIKey

FZBVNPRKYAHVCA-UHFFFAOYSA-N

Compound name

5,8-dioxa-2-azaspiro[3.4]octane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 67
Patents: 115.06333 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]+	116.07061	118.7
[M+Na]+	138.05255	124.0
[M+NH4]+	133.09715	124.6
[M+K]+	154.02649	122.2
[M-H]-	114.05605	119.2
[M+Na-2H]-	136.03800	121.6
[M]+	115.06278	118.3
[M]-	115.06388	118.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe