CID 23414295

17005-57-1

Structural Information

Molecular Formula

C₁₂H₂₀NP

SMILES

CCP(CC)C1=CC=C(C=C1)N(C)C

InChI

InChI=1S/C12H20NP/c1-5-14(6-2)12-9-7-11(8-10-12)13(3)4/h7-10H,5-6H2,1-4H3

InChIKey

FMNOWZMFKYVARU-UHFFFAOYSA-N

Compound name

4-diethylphosphanyl-N,N-dimethylaniline

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 209.13333 Da
Monoisotopic Mass: 2.3
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]+	210.14061	153.1
[M+Na]+	232.12255	158.7
[M-H]-	208.12605	156.6
[M+NH4]+	227.16715	173.1
[M+K]+	248.09649	157.7
[M+H-H2O]+	192.13059	144.3
[M+HCOO]-	254.13153	182.2
[M+CH3COO]-	268.14718	197.8
[M+Na-2H]-	230.10800	153.0
[M]+	209.13278	155.9
[M]-	209.13388	155.9

Literature stripe

literature stripe

Patent stripe

patents stripe