CID 18985154

3221-25-8

Structural Information

Molecular Formula

C₈H₁₈N₂O

SMILES

CCN1CCN(CC1)CCO

InChI

InChI=1S/C8H18N2O/c1-2-9-3-5-10(6-4-9)7-8-11/h11H,2-8H2,1H3

InChIKey

HYSZWUPCSXTPSX-UHFFFAOYSA-N

Compound name

2-(4-ethylpiperazin-1-yl)ethanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 774
Patents: 158.1419 Da
Monoisotopic Mass: -0.2
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]+	159.14918	138.2
[M+Na]+	181.13112	143.4
[M-H]-	157.13462	136.7
[M+NH4]+	176.17572	155.7
[M+K]+	197.10506	141.9
[M+H-H2O]+	141.13916	131.1
[M+HCOO]-	203.14010	154.7
[M+CH3COO]-	217.15575	175.3
[M+Na-2H]-	179.11657	142.6
[M]+	158.14135	134.3
[M]-	158.14245	134.3

Literature stripe

literature stripe

Patent stripe

patents stripe