CID 15083623

Ethyl hydrogen diethylamidophosphate

Structural Information

Molecular Formula

C₆H₁₆NO₃P

SMILES

CCN(CC)P(=O)(O)OCC

InChI

InChI=1S/C6H16NO3P/c1-4-7(5-2)11(8,9)10-6-3/h4-6H2,1-3H3,(H,8,9)

InChIKey

DUNFIZRDIMDMIH-UHFFFAOYSA-N

Compound name

ethoxy-N,N-diethylphosphonamidic acid

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 46
Patents: 181.08678 Da
Monoisotopic Mass: 0.3
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]+	182.09406	142.2
[M+Na]+	204.07600	148.5
[M-H]-	180.07950	141.4
[M+NH4]+	199.12060	162.6
[M+K]+	220.04994	149.6
[M+H-H2O]+	164.08404	135.2
[M+HCOO]-	226.08498	170.5
[M+CH3COO]-	240.10063	185.2
[M+Na-2H]-	202.06145	145.3
[M]+	181.08623	146.8
[M]-	181.08733	146.8

Literature stripe

literature stripe

Patent stripe

patents stripe