CID 11345737

323176-93-8

Structural Information

Molecular Formula

C₁₄H₂₁NO₃

SMILES

CCOC(=O)C(CN(C)C)C1=CC=C(C=C1)OC

InChI

InChI=1S/C14H21NO3/c1-5-18-14(16)13(10-15(2)3)11-6-8-12(17-4)9-7-11/h6-9,13H,5,10H2,1-4H3

InChIKey

AYXZUXPFYCNRFQ-UHFFFAOYSA-N

Compound name

ethyl 3-(dimethylamino)-2-(4-methoxyphenyl)propanoate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 4
Patents: 251.15215 Da
Monoisotopic Mass: 2.1
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]+	252.15943	158.9
[M+Na]+	274.14137	169.1
[M+NH4]+	269.18597	165.8
[M+K]+	290.11531	164.1
[M-H]-	250.14487	160.6
[M+Na-2H]-	272.12682	163.9
[M]+	251.15160	160.6
[M]-	251.15270	160.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe