CID 3060452

78133-05-8

Structural Information

Molecular Formula

C₁₄H₁₆NO₂P

SMILES

CCOP(=O)(C1=CC=CC=C1)NC2=CC=CC=C2

InChI

InChI=1S/C14H16NO2P/c1-2-17-18(16,14-11-7-4-8-12-14)15-13-9-5-3-6-10-13/h3-12H,2H2,1H3,(H,15,16)

InChIKey

SWMWBECAEDVEDX-UHFFFAOYSA-N

Compound name

N-[ethoxy(phenyl)phosphoryl]aniline

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 2
Patents: 261.09186 Da
Monoisotopic Mass: 3.2
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]+	262.09914	160.6
[M+Na]+	284.08108	166.1
[M-H]-	260.08458	165.6
[M+NH4]+	279.12568	176.9
[M+K]+	300.05502	163.0
[M+H-H2O]+	244.08912	150.5
[M+HCOO]-	306.09006	189.9
[M+CH3COO]-	320.10571	197.6
[M+Na-2H]-	282.06653	165.4
[M]+	261.09131	161.6
[M]-	261.09241	161.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe