CID 95712

Phosphoramidic acid, methyl-, diethyl ester

Structural Information

Molecular Formula

C₅H₁₄NO₃P

SMILES

CCOP(=O)(NC)OCC

InChI

InChI=1S/C5H14NO3P/c1-4-8-10(7,6-3)9-5-2/h4-5H2,1-3H3,(H,6,7)

InChIKey

SQWJXFWCAVVZGI-UHFFFAOYSA-N

Compound name

N-diethoxyphosphorylmethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 31
Patents: 167.07114 Da
Monoisotopic Mass: 0.0
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]+	168.07842	135.9
[M+Na]+	190.06036	143.9
[M+NH4]+	185.10496	142.1
[M+K]+	206.03430	140.3
[M-H]-	166.06386	133.9
[M+Na-2H]-	188.04581	138.3
[M]+	167.07059	136.0
[M]-	167.07169	136.0

Literature stripe

literature stripe

Patent stripe

patents stripe