CID 50990582

2-hydroxy-2-(piperidin-4-yl)acetic acid hydrochloride

Structural Information

Molecular Formula

C₇H₁₃NO₃

SMILES

C1CNCCC1C(C(=O)O)O

InChI

InChI=1S/C7H13NO3/c9-6(7(10)11)5-1-3-8-4-2-5/h5-6,8-9H,1-4H2,(H,10,11)

InChIKey

KDBOBQCTMQRDBV-UHFFFAOYSA-N

Compound name

2-hydroxy-2-piperidin-4-ylacetic acid

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 10
Patents: 159.08954 Da
Monoisotopic Mass: -2.8
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]+	160.096816	135.4
[M+Na]+	182.078758	138.9
[M-H]-	158.082264	132.5
[M+NH4]+	177.123363	152.1
[M+K]+	198.052698	137.3
[M+H-H2O]+	142.086800	129.6
[M+HCOO]-	204.087741	149.2
[M+CH3COO]-	218.103391	168.3
[M+Na-2H]-	180.064206	137.6
[M]+	159.08899142	127.4
[M]-	159.09008858	127.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe