CID 3060969

Brn 5760950

Structural Information

Molecular Formula

C₁₇H₂₉N₃O₂

SMILES

CCN(C)CC(C(=O)NC1=CC=CC=C1OCC)N(C)CC

InChI

InChI=1S/C17H29N3O2/c1-6-19(4)13-15(20(5)7-2)17(21)18-14-11-9-10-12-16(14)22-8-3/h9-12,15H,6-8,13H2,1-5H3,(H,18,21)

InChIKey

UFKLAIFNSJRXHJ-UHFFFAOYSA-N

Compound name

N-(2-ethoxyphenyl)-2,3-bis[ethyl(methyl)amino]propanamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 0
Patents: 307.22598 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]+	308.233256	179.3
[M+Na]+	330.215198	181.6
[M-H]-	306.218704	184.7
[M+NH4]+	325.259803	194.4
[M+K]+	346.189138	182.1
[M+H-H2O]+	290.223240	170.5
[M+HCOO]-	352.224181	203.8
[M+CH3COO]-	366.239831	222.6
[M+Na-2H]-	328.200646	179.4
[M]+	307.22543142	183.5
[M]-	307.22652858	183.5

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.