CID 20640225

2253632-91-4

Structural Information

Molecular Formula

C₈H₁₃NO₂

SMILES

C1CC2(CC1CC2N)C(=O)O

InChI

InChI=1S/C8H13NO2/c9-6-3-5-1-2-8(6,4-5)7(10)11/h5-6H,1-4,9H2,(H,10,11)

InChIKey

WBXOONOXOHMGQW-UHFFFAOYSA-N

Compound name

2-aminobicyclo[2.2.1]heptane-1-carboxylic acid

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 2
References: 506
Patents: 155.09464 Da
Monoisotopic Mass: -1.6
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]+	156.10192	133.0
[M+Na]+	178.08386	139.2
[M+NH4]+	173.12846	142.7
[M+K]+	194.05780	137.1
[M-H]-	154.08736	132.3
[M+Na-2H]-	176.06931	134.5
[M]+	155.09409	133.3
[M]-	155.09519	133.3

Literature stripe

literature stripe

Patent stripe

patents stripe