CID 29530

2-anilinoethyl methacrylate

Structural Information

Molecular Formula

C₁₂H₁₅NO₂

SMILES

CC(=C)C(=O)OCCNC1=CC=CC=C1

InChI

InChI=1S/C12H15NO2/c1-10(2)12(14)15-9-8-13-11-6-4-3-5-7-11/h3-7,13H,1,8-9H2,2H3

InChIKey

UGCSBAYAYZNGRD-UHFFFAOYSA-N

Compound name

2-anilinoethyl 2-methylprop-2-enoate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1455
Patents: 205.11028 Da
Monoisotopic Mass: 2.8
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]+	206.11756	147.4
[M+Na]+	228.09950	157.9
[M+NH4]+	223.14410	154.7
[M+K]+	244.07344	152.0
[M-H]-	204.10300	149.0
[M+Na-2H]-	226.08495	153.2
[M]+	205.10973	149.1
[M]-	205.11083	149.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe