CID 216098

Dempa

Structural Information

Molecular Formula

C₈H₁₈NO₄P

SMILES

CCOP(=O)(N1CCOCC1)OCC

InChI

InChI=1S/C8H18NO4P/c1-3-12-14(10,13-4-2)9-5-7-11-8-6-9/h3-8H2,1-2H3

InChIKey

GNLJOAHHAPACCT-UHFFFAOYSA-N

Compound name

4-diethoxyphosphorylmorpholine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 856
Patents: 223.09735 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]+	224.10463	151.4
[M+Na]+	246.08657	156.0
[M-H]-	222.09007	152.0
[M+NH4]+	241.13117	167.2
[M+K]+	262.06051	157.7
[M+H-H2O]+	206.09461	142.4
[M+HCOO]-	268.09555	174.3
[M+CH3COO]-	282.11120	186.7
[M+Na-2H]-	244.07202	155.2
[M]+	223.09680	153.7
[M]-	223.09790	153.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe