CID 85676205

Ethyl (2-aminoethyl)(methyl)phosphinate

Structural Information

Molecular Formula

C₅H₁₄NO₂P

SMILES

CCOP(=O)(C)CCN

InChI

InChI=1S/C5H14NO2P/c1-3-8-9(2,7)5-4-6/h3-6H2,1-2H3

InChIKey

OUJHAEXJBIOGNQ-UHFFFAOYSA-N

Compound name

2-[ethoxy(methyl)phosphoryl]ethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 33
Patents: 151.07622 Da
Monoisotopic Mass: -1.1
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]+	152.08350	135.4
[M+Na]+	174.06544	142.4
[M-H]-	150.06894	134.2
[M+NH4]+	169.11004	156.9
[M+K]+	190.03938	142.4
[M+H-H2O]+	134.07348	128.7
[M+HCOO]-	196.07442	164.1
[M+CH3COO]-	210.09007	178.6
[M+Na-2H]-	172.05089	139.0
[M]+	151.07567	137.9
[M]-	151.07677	137.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe