CID 13217353

88578-97-6

Structural Information

Molecular Formula

C₁₀H₁₇NO₂

SMILES

C1CCC2(CC1)CC(NC2)C(=O)O

InChI

InChI=1S/C10H17NO2/c12-9(13)8-6-10(7-11-8)4-2-1-3-5-10/h8,11H,1-7H2,(H,12,13)

InChIKey

QATSWWZBTBBYRX-UHFFFAOYSA-N

Compound name

2-azaspiro[4.5]decane-3-carboxylic acid

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 258
Patents: 183.12593 Da
Monoisotopic Mass: -0.5
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]+	184.13321	144.2
[M+Na]+	206.11515	151.7
[M+NH4]+	201.15975	153.2
[M+K]+	222.08909	146.9
[M-H]-	182.11865	144.5
[M+Na-2H]-	204.10060	148.0
[M]+	183.12538	145.0
[M]-	183.12648	145.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe