CID 2733351

685-83-6

Structural Information

Molecular Formula

C₈H₂₀ClN₂P

SMILES

CCN(CC)P(N(CC)CC)Cl

InChI

InChI=1S/C8H20ClN2P/c1-5-10(6-2)12(9)11(7-3)8-4/h5-8H2,1-4H3

InChIKey

JVEHJSIFWIIFHM-UHFFFAOYSA-N

Compound name

N-[chloro(diethylamino)phosphanyl]-N-ethylethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 3
References: 233
Patents: 210.10527 Da
Monoisotopic Mass: 2.7
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]+	211.112546	153.2
[M+Na]+	233.094488	158.5
[M-H]-	209.097994	154.8
[M+NH4]+	228.139093	174.4
[M+K]+	249.068428	158.3
[M+H-H2O]+	193.102530	145.9
[M+HCOO]-	255.103471	179.0
[M+CH3COO]-	269.119121	201.7
[M+Na-2H]-	231.079936	152.4
[M]+	210.10472142	159.2
[M]-	210.10581858	159.2

Literature stripe

literature stripe

Patent stripe

patents stripe