CID 18506884

2-hydroxy-1-(piperazin-1-yl)ethan-1-one

Structural Information

Molecular Formula

C₆H₁₂N₂O₂

SMILES

C1CN(CCN1)C(=O)CO

InChI

InChI=1S/C6H12N2O2/c9-5-6(10)8-3-1-7-2-4-8/h7,9H,1-5H2

InChIKey

YKZWLZLFBNIZCC-UHFFFAOYSA-N

Compound name

2-hydroxy-1-piperazin-1-ylethanone

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 468
Patents: 144.08987 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]+	145.097146	132.2
[M+Na]+	167.079088	137.0
[M-H]-	143.082594	129.4
[M+NH4]+	162.123693	149.1
[M+K]+	183.053028	135.4
[M+H-H2O]+	127.087130	125.5
[M+HCOO]-	189.088071	147.4
[M+CH3COO]-	203.103721	166.9
[M+Na-2H]-	165.064536	136.7
[M]+	144.08932142	125.4
[M]-	144.09041858	125.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe