CID 359811

2-cyano-n-(4-ethoxyphenyl)acetamide

Structural Information

Molecular Formula

C₁₁H₁₂N₂O₂

SMILES

CCOC1=CC=C(C=C1)NC(=O)CC#N

InChI

InChI=1S/C11H12N2O2/c1-2-15-10-5-3-9(4-6-10)13-11(14)7-8-12/h3-6H,2,7H2,1H3,(H,13,14)

InChIKey

OVLKYXWCLMCKIB-UHFFFAOYSA-N

Compound name

2-cyano-N-(4-ethoxyphenyl)acetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 2
References: 5
Patents: 204.08987 Da
Monoisotopic Mass: 2.0
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]+	205.09715	147.5
[M+Na]+	227.07909	158.1
[M+NH4]+	222.12369	151.4
[M+K]+	243.05303	149.1
[M-H]-	203.08259	141.9
[M+Na-2H]-	225.06454	150.7
[M]+	204.08932	146.4
[M]-	204.09042	146.4

Literature stripe

literature stripe

Patent stripe

patents stripe