CID 1514306

Dtxsid00628844

Structural Information

Molecular Formula

C₆H₁₂N₂O₂

SMILES

C1CNCCC1(C(=O)O)N

InChI

InChI=1S/C6H12N2O2/c7-6(5(9)10)1-3-8-4-2-6/h8H,1-4,7H2,(H,9,10)

InChIKey

KHABBYNLBYZCKP-UHFFFAOYSA-N

Compound name

4-aminopiperidine-4-carboxylic acid

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 4
References: 2312
Patents: 144.08987 Da
Monoisotopic Mass: -3.5
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]+	145.09715	131.3
[M+Na]+	167.07909	136.1
[M-H]-	143.08259	129.8
[M+NH4]+	162.12369	150.9
[M+K]+	183.05303	134.4
[M+H-H2O]+	127.08713	126.2
[M+HCOO]-	189.08807	148.2
[M+CH3COO]-	203.10372	168.7
[M+Na-2H]-	165.06454	136.2
[M]+	144.08932	122.7
[M]-	144.09042	122.7

Literature stripe

literature stripe

Patent stripe

patents stripe