CID 11788288

Piperazin-2-ylmethanol dihydrochloride

Structural Information

Molecular Formula

C₅H₁₂N₂O

SMILES

C1CNC(CN1)CO

InChI

InChI=1S/C5H12N2O/c8-4-5-3-6-1-2-7-5/h5-8H,1-4H2

InChIKey

SIRSTRHGFGFVME-UHFFFAOYSA-N

Compound name

piperazin-2-ylmethanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 536
Patents: 116.09496 Da
Monoisotopic Mass: -1.5
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]+	117.10224	125.2
[M+Na]+	139.08418	134.5
[M+NH4]+	134.12878	132.5
[M+K]+	155.05812	129.8
[M-H]-	115.08768	124.3
[M+Na-2H]-	137.06963	128.9
[M]+	116.09441	125.8
[M]-	116.09551	125.8

Literature stripe

literature stripe

Patent stripe

patents stripe