CID 2759308

124335-65-5

Structural Information

Molecular Formula

C₈H₁₆N₂O₃

SMILES

C1CN(CCN1CCO)CC(=O)O

InChI

InChI=1S/C8H16N2O3/c11-6-5-9-1-3-10(4-2-9)7-8(12)13/h11H,1-7H2,(H,12,13)

InChIKey

VCEKKKPFXABURR-UHFFFAOYSA-N

Compound name

2-[4-(2-hydroxyethyl)piperazin-1-yl]acetic acid

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 39
Patents: 188.11609 Da
Monoisotopic Mass: -3.3
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]+	189.12337	143.0
[M+Na]+	211.10531	151.4
[M+NH4]+	206.14991	148.6
[M+K]+	227.07925	147.7
[M-H]-	187.10881	141.0
[M+Na-2H]-	209.09076	144.9
[M]+	188.11554	143.1
[M]-	188.11664	143.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe