CID 56763830

2361645-25-0

Structural Information

Molecular Formula

C₁₀H₁₇NO₂

SMILES

C1CC(=O)CCC1N2CCOCC2

InChI

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

InChIKey

XQSZENOTKVEPEU-UHFFFAOYSA-N

Compound name

4-morpholin-4-ylcyclohexan-1-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 112
Patents: 183.12593 Da
Monoisotopic Mass: 0.1
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	141.4
[M+Na]+	206.115148	144.7
[M-H]-	182.118654	145.7
[M+NH4]+	201.159753	157.8
[M+K]+	222.089088	144.4
[M+H-H2O]+	166.123190	133.7
[M+HCOO]-	228.124131	156.8
[M+CH3COO]-	242.139781	179.1
[M+Na-2H]-	204.100596	145.6
[M]+	183.12538142	134.1
[M]-	183.12647858	134.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe