CID 84075561

1779647-65-2

Structural Information

Molecular Formula

C₉H₁₅NO₂

SMILES

COC(=O)C1CCC2(N1)CCC2

InChI

InChI=1S/C9H15NO2/c1-12-8(11)7-3-6-9(10-7)4-2-5-9/h7,10H,2-6H2,1H3

InChIKey

DCFWSLKRNVNVCL-UHFFFAOYSA-N

Compound name

methyl 5-azaspiro[3.4]octane-6-carboxylate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 169.11028 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]+	170.11756	139.4
[M+Na]+	192.09950	143.2
[M+NH4]+	187.14410	144.5
[M+K]+	208.07344	140.5
[M-H]-	168.10300	136.8
[M+Na-2H]-	190.08495	141.2
[M]+	169.10973	137.8
[M]-	169.11083	137.8

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.