CID 48102

N-ethyl-n-(1-phenylethyl)acetamide

Structural Information

Molecular Formula

C₁₂H₁₇NO

SMILES

CCN(C(C)C1=CC=CC=C1)C(=O)C

InChI

InChI=1S/C12H17NO/c1-4-13(11(3)14)10(2)12-8-6-5-7-9-12/h5-10H,4H2,1-3H3

InChIKey

VELYNJNBQPPHCZ-UHFFFAOYSA-N

Compound name

N-ethyl-N-(1-phenylethyl)acetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 191.13101 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]+	192.13829	144.7
[M+Na]+	214.12023	155.9
[M+NH4]+	209.16483	153.1
[M+K]+	230.09417	150.1
[M-H]-	190.12373	147.5
[M+Na-2H]-	212.10568	151.3
[M]+	191.13046	147.0
[M]-	191.13156	147.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe