CID 4742514

116882-73-6

Structural Information

Molecular Formula

C₇H₁₅N₃O₂

SMILES

C1CN(CCN1CCO)C(=O)N

InChI

InChI=1S/C7H15N3O2/c8-7(12)10-3-1-9(2-4-10)5-6-11/h11H,1-6H2,(H2,8,12)

InChIKey

VTWZAXWDPQYNEU-UHFFFAOYSA-N

Compound name

4-(2-hydroxyethyl)piperazine-1-carboxamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 40
Patents: 173.11642 Da
Monoisotopic Mass: -1.7
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]+	174.123696	139.8
[M+Na]+	196.105638	144.7
[M-H]-	172.109144	138.1
[M+NH4]+	191.150243	155.9
[M+K]+	212.079578	143.3
[M+H-H2O]+	156.113680	132.5
[M+HCOO]-	218.114621	156.5
[M+CH3COO]-	232.130271	178.0
[M+Na-2H]-	194.091086	142.8
[M]+	173.11587142	133.9
[M]-	173.11696858	133.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe