CID 5195381

Diethylphosphinoyl chloride

Structural Information

Molecular Formula

C₄H₁₀ClOP

SMILES

CCP(=O)(CC)Cl

InChI

InChI=1S/C4H10ClOP/c1-3-7(5,6)4-2/h3-4H2,1-2H3

InChIKey

KGENPKAWPRUNIG-UHFFFAOYSA-N

Compound name

1-[chloro(ethyl)phosphoryl]ethane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 828
Patents: 140.01578 Da
Monoisotopic Mass: 0.9
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]+	141.02306	127.4
[M+Na]+	163.00500	136.7
[M-H]-	139.00850	127.1
[M+NH4]+	158.04960	150.9
[M+K]+	178.97894	134.7
[M+H-H2O]+	123.01304	122.7
[M+HCOO]-	185.01398	151.4
[M+CH3COO]-	199.02963	173.5
[M+Na-2H]-	160.99045	132.2
[M]+	140.01523	131.8
[M]-	140.01633	131.8

Literature stripe

literature stripe

Patent stripe

patents stripe