CID 17111

2-(dimethylamino)ethyl acrylate

Structural Information

Molecular Formula

C₇H₁₃NO₂

SMILES

CN(C)CCOC(=O)C=C

InChI

InChI=1S/C7H13NO2/c1-4-7(9)10-6-5-8(2)3/h4H,1,5-6H2,2-3H3

InChIKey

DPBJAVGHACCNRL-UHFFFAOYSA-N

Compound name

2-(dimethylamino)ethyl prop-2-enoate

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 9
References: 65794
Patents: 143.09464 Da
Monoisotopic Mass: 0.5
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]+	144.10192	131.5
[M+Na]+	166.08386	140.7
[M+NH4]+	161.12846	138.7
[M+K]+	182.05780	136.0
[M-H]-	142.08736	131.0
[M+Na-2H]-	164.06931	134.8
[M]+	143.09409	132.3
[M]-	143.09519	132.3

Literature stripe

literature stripe

Patent stripe

patents stripe