CID 74788211

2-oxa-5,8-diazaspiro[3.5]nonane

Structural Information

Molecular Formula

C₆H₁₂N₂O

SMILES

C1CNC2(CN1)COC2

InChI

InChI=1S/C6H12N2O/c1-2-8-6(3-7-1)4-9-5-6/h7-8H,1-5H2

InChIKey

SDYCEPNUOZPFMG-UHFFFAOYSA-N

Compound name

2-oxa-5,8-diazaspiro[3.5]nonane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 75
Patents: 128.09496 Da
Monoisotopic Mass: -1.3
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]+	129.10224	126.5
[M+Na]+	151.08418	132.1
[M+NH4]+	146.12878	132.0
[M+K]+	167.05812	127.6
[M-H]-	127.08768	125.6
[M+Na-2H]-	149.06963	129.8
[M]+	128.09441	125.7
[M]-	128.09551	125.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe