CID 21647091

1-ethoxypiperazine

Structural Information

Molecular Formula

C₆H₁₄N₂O

SMILES

CCON1CCNCC1

InChI

InChI=1S/C6H14N2O/c1-2-9-8-5-3-7-4-6-8/h7H,2-6H2,1H3

InChIKey

WGIAYBNWTYECJD-UHFFFAOYSA-N

Compound name

1-ethoxypiperazine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 599
Patents: 130.11061 Da
Monoisotopic Mass: 0.0
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]+	131.117886	129.3
[M+Na]+	153.099828	134.4
[M-H]-	129.103334	127.7
[M+NH4]+	148.144433	147.6
[M+K]+	169.073768	133.4
[M+H-H2O]+	113.107870	122.3
[M+HCOO]-	175.108811	146.5
[M+CH3COO]-	189.124461	168.1
[M+Na-2H]-	151.085276	135.5
[M]+	130.11006142	124.3
[M]-	130.11115858	124.3

Literature stripe

literature stripe

Patent stripe

patents stripe