CID 3458768

452351-77-8

Structural Information

Molecular Formula

C₁₀H₁₇NO₂

SMILES

C1CCN(CC1)C(=O)C2CCCO2

InChI

InChI=1S/C10H17NO2/c12-10(9-5-4-8-13-9)11-6-2-1-3-7-11/h9H,1-8H2

InChIKey

XEQPIEHZKKGIDC-UHFFFAOYSA-N

Compound name

oxolan-2-yl(piperidin-1-yl)methanone

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 6
Patents: 183.12593 Da
Monoisotopic Mass: 1.0
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]+	184.133206	142.4
[M+Na]+	206.115148	145.5
[M-H]-	182.118654	146.7
[M+NH4]+	201.159753	160.4
[M+K]+	222.089088	145.6
[M+H-H2O]+	166.123190	135.2
[M+HCOO]-	228.124131	158.9
[M+CH3COO]-	242.139781	177.8
[M+Na-2H]-	204.100596	144.4
[M]+	183.12538142	136.1
[M]-	183.12647858	136.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe