CID 3014237

3770-22-7

Structural Information

Molecular Formula

SMILES

C1CC(NC(=O)C1)C(=O)O

InChI

InChI=1S/C6H9NO3/c8-5-3-1-2-4(7-5)6(9)10/h4H,1-3H2,(H,7,8)(H,9,10)

InChIKey

FZXCPFJMYOQZCA-UHFFFAOYSA-N

Compound name

6-oxopiperidine-2-carboxylic acid

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 11
References: 554
Patents: 143.05824 Da
Monoisotopic Mass: -0.4
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]+	144.06552	129.1
[M+Na]+	166.04746	138.2
[M+NH4]+	161.09206	135.6
[M+K]+	182.02140	134.6
[M-H]-	142.05096	127.9
[M+Na-2H]-	164.03291	131.9
[M]+	143.05769	129.5
[M]-	143.05879	129.5

Literature stripe

literature stripe

Patent stripe

patents stripe