CID 29721

(4'-benzyloxy-2-diethylamino)acetanilide hydrochloride

Structural Information

Molecular Formula

C₁₉H₂₄N₂O₂

SMILES

CCN(CC)CC(=O)NC1=CC=C(C=C1)OCC2=CC=CC=C2

InChI

InChI=1S/C19H24N2O2/c1-3-21(4-2)14-19(22)20-17-10-12-18(13-11-17)23-15-16-8-6-5-7-9-16/h5-13H,3-4,14-15H2,1-2H3,(H,20,22)

InChIKey

LHTFUSCYYKZEQW-UHFFFAOYSA-N

Compound name

2-(diethylamino)-N-(4-phenylmethoxyphenyl)acetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 312.18378 Da
Monoisotopic Mass: 3.4
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]+	313.191056	176.7
[M+Na]+	335.172998	180.2
[M-H]-	311.176504	183.8
[M+NH4]+	330.217603	190.8
[M+K]+	351.146938	177.6
[M+H-H2O]+	295.181040	167.2
[M+HCOO]-	357.181981	201.5
[M+CH3COO]-	371.197631	214.8
[M+Na-2H]-	333.158446	180.0
[M]+	312.18323142	179.0
[M]-	312.18432858	179.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe