CID 132319

Vuf 8929

Structural Information

Molecular Formula

C₂₃H₂₃F₂NO

SMILES

CCN(CCC1=CC=CC=C1)OCC2=C(C=C(C=C2)F)C3=CC=C(C=C3)F

InChI

InChI=1S/C23H23F2NO/c1-2-26(15-14-18-6-4-3-5-7-18)27-17-20-10-13-22(25)16-23(20)19-8-11-21(24)12-9-19/h3-13,16H,2,14-15,17H2,1H3

InChIKey

GGMYTEKOQOOTDL-UHFFFAOYSA-N

Compound name

N-ethyl-N-[[4-fluoro-2-(4-fluorophenyl)phenyl]methoxy]-2-phenylethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 2
Patents: 367.17477 Da
Monoisotopic Mass: 6.0
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]+	368.182046	189.5
[M+Na]+	390.163988	195.5
[M-H]-	366.167494	197.2
[M+NH4]+	385.208593	201.7
[M+K]+	406.137928	189.8
[M+H-H2O]+	350.172030	177.1
[M+HCOO]-	412.172971	211.5
[M+CH3COO]-	426.188621	223.7
[M+Na-2H]-	388.149436	191.1
[M]+	367.17422142	189.8
[M]-	367.17531858	189.8

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.