CID 72893

N-(4-ethylphenyl)acetamide

Structural Information

Molecular Formula

C₁₀H₁₃NO

SMILES

CCC1=CC=C(C=C1)NC(=O)C

InChI

InChI=1S/C10H13NO/c1-3-9-4-6-10(7-5-9)11-8(2)12/h4-7H,3H2,1-2H3,(H,11,12)

InChIKey

HOPWGOFWAPWHDS-UHFFFAOYSA-N

Compound name

N-(4-ethylphenyl)acetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 449
Patents: 163.09972 Da
Monoisotopic Mass: 2.2
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]+	164.10700	135.5
[M+Na]+	186.08894	147.7
[M+NH4]+	181.13354	144.2
[M+K]+	202.06288	141.2
[M-H]-	162.09244	138.3
[M+Na-2H]-	184.07439	142.6
[M]+	163.09917	137.9
[M]-	163.10027	137.9

Literature stripe

literature stripe

Patent stripe

patents stripe