CID 135392148

2,5-dioxaspiro[3.5]nonan-7-amine

Structural Information

Molecular Formula

C₇H₁₃NO₂

SMILES

C1CC2(COC2)OCC1N

InChI

InChI=1S/C7H13NO2/c8-6-1-2-7(10-3-6)4-9-5-7/h6H,1-5,8H2

InChIKey

AAOOCUFVSJUTLO-UHFFFAOYSA-N

Compound name

2,5-dioxaspiro[3.5]nonan-7-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 143.09464 Da
Monoisotopic Mass: -0.8
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]+	144.10192	129.7
[M+Na]+	166.08386	135.2
[M+NH4]+	161.12846	136.0
[M+K]+	182.05780	131.0
[M-H]-	142.08736	132.3
[M+Na-2H]-	164.06931	132.9
[M]+	143.09409	130.0
[M]-	143.09519	130.0

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.