CID 2760443

73331-93-8

Structural Information

Molecular Formula

C₉H₁₇N₃O

SMILES

C1CCN(C1)C(=O)N2CCNCC2

InChI

InChI=1S/C9H17N3O/c13-9(11-5-1-2-6-11)12-7-3-10-4-8-12/h10H,1-8H2

InChIKey

YKELOMQESZMHBK-UHFFFAOYSA-N

Compound name

piperazin-1-yl(pyrrolidin-1-yl)methanone

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 135
Patents: 183.13716 Da
Monoisotopic Mass: -0.4
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]+	184.144436	144.9
[M+Na]+	206.126378	148.0
[M-H]-	182.129884	144.5
[M+NH4]+	201.170983	160.9
[M+K]+	222.100318	146.0
[M+H-H2O]+	166.134420	135.8
[M+HCOO]-	228.135361	158.3
[M+CH3COO]-	242.151011	175.1
[M+Na-2H]-	204.111826	145.8
[M]+	183.13661142	135.3
[M]-	183.13770858	135.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe