CID 69931

796-77-0

Structural Information

Molecular Formula

C₁₉H₂₃NO₂

SMILES

CCN(CC)CCOC1=CC=C(C=C1)C(=O)C2=CC=CC=C2

InChI

InChI=1S/C19H23NO2/c1-3-20(4-2)14-15-22-18-12-10-17(11-13-18)19(21)16-8-6-5-7-9-16/h5-13H,3-4,14-15H2,1-2H3

InChIKey

GSTOOYJSPRJGDO-UHFFFAOYSA-N

Compound name

[4-[2-(diethylamino)ethoxy]phenyl]-phenylmethanone

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 14
Patents: 297.17288 Da
Monoisotopic Mass: 4.0
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]+	298.18016	172.8
[M+Na]+	320.16210	185.7
[M+NH4]+	315.20670	180.8
[M+K]+	336.13604	177.6
[M-H]-	296.16560	177.9
[M+Na-2H]-	318.14755	181.5
[M]+	297.17233	176.1
[M]-	297.17343	176.1

Literature stripe

literature stripe

Patent stripe

patents stripe