CID 23103

6622-73-7

Structural Information

Molecular Formula

C₁₁H₁₃NO₂

SMILES

CC(=O)NC1=CC=C(C=C1)OCC=C

InChI

InChI=1S/C11H13NO2/c1-3-8-14-11-6-4-10(5-7-11)12-9(2)13/h3-7H,1,8H2,2H3,(H,12,13)

InChIKey

UVGQOPZEALYXKP-UHFFFAOYSA-N

Compound name

N-(4-prop-2-enoxyphenyl)acetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 19
Patents: 191.09464 Da
Monoisotopic Mass: 1.7
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]+	192.10192	142.4
[M+Na]+	214.08386	153.9
[M+NH4]+	209.12846	150.0
[M+K]+	230.05780	147.6
[M-H]-	190.08736	144.3
[M+Na-2H]-	212.06931	148.6
[M]+	191.09409	144.3
[M]-	191.09519	144.3

Literature stripe

literature stripe

Patent stripe

patents stripe