CID 175136

Einecs 276-812-6

Structural Information

Molecular Formula

C₆H₁₄NO₆P

SMILES

CCOP(=O)(CO)OCCOC(=O)N

InChI

InChI=1S/C6H14NO6P/c1-2-12-14(10,5-8)13-4-3-11-6(7)9/h8H,2-5H2,1H3,(H2,7,9)

InChIKey

UCLMAMCZTXSICG-UHFFFAOYSA-N

Compound name

2-[ethoxy(hydroxymethyl)phosphoryl]oxyethyl carbamate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 227.05588 Da
Monoisotopic Mass: -1.4
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]+	228.06316	148.0
[M+Na]+	250.04510	153.8
[M-H]-	226.04860	145.1
[M+NH4]+	245.08970	165.2
[M+K]+	266.01904	154.7
[M+H-H2O]+	210.05314	140.5
[M+HCOO]-	272.05408	175.0
[M+CH3COO]-	286.06973	186.8
[M+Na-2H]-	248.03055	150.3
[M]+	227.05533	153.1
[M]-	227.05643	153.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe