CID 12008608

Tetra(diethylamino)phosphonium bromide

Structural Information

Molecular Formula

C₁₆H₄₀BrN₄P

SMILES

CCN(CC)P(N(CC)CC)(N(CC)CC)(N(CC)CC)Br

InChI

InChI=1S/C16H40BrN4P/c1-9-18(10-2)22(17,19(11-3)12-4,20(13-5)14-6)21(15-7)16-8/h9-16H2,1-8H3

InChIKey

CTNZKNIQIDUKKS-UHFFFAOYSA-N

Compound name

N-[bromo-tris(diethylamino)-lambda5-phosphanyl]-N-ethylethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 38
Patents: 398.2174 Da
Monoisotopic Mass: 4.8
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]+	399.22468	188.6
[M+Na]+	421.20662	185.0
[M+NH4]+	416.25122	191.1
[M+K]+	437.18056	185.8
[M-H]-	397.21012	189.0
[M+Na-2H]-	419.19207	187.1
[M]+	398.21685	186.6
[M]-	398.21795	186.6

Literature stripe

literature stripe

Patent stripe

patents stripe