CID 138012124

2243510-57-6

Structural Information

Molecular Formula

C₉H₁₅NO₂

SMILES

C1CC2(C1)CCNCC2C(=O)O

InChI

InChI=1S/C9H15NO2/c11-8(12)7-6-10-5-4-9(7)2-1-3-9/h7,10H,1-6H2,(H,11,12)

InChIKey

XCDVWEBCBQJRKC-UHFFFAOYSA-N

Compound name

7-azaspiro[3.5]nonane-9-carboxylic acid

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 169.11028 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]+	170.11756	140.1
[M+Na]+	192.09950	144.5
[M+NH4]+	187.14410	145.1
[M+K]+	208.07344	140.0
[M-H]-	168.10300	137.8
[M+Na-2H]-	190.08495	142.3
[M]+	169.10973	138.6
[M]-	169.11083	138.6

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.