CID 53953

Acetanilide, 2-(diethylamino)-3',5'-dimethyl-, hydrochloride

Structural Information

Molecular Formula

C₁₄H₂₂N₂O

SMILES

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

InChI

InChI=1S/C14H22N2O/c1-5-16(6-2)10-14(17)15-13-8-11(3)7-12(4)9-13/h7-9H,5-6,10H2,1-4H3,(H,15,17)

InChIKey

JEGVQGHWBTYVRY-UHFFFAOYSA-N

Compound name

2-(diethylamino)-N-(3,5-dimethylphenyl)acetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 3
Patents: 234.17322 Da
Monoisotopic Mass: 2.6
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]+	235.18050	157.5
[M+Na]+	257.16244	168.1
[M+NH4]+	252.20704	165.1
[M+K]+	273.13638	161.7
[M-H]-	233.16594	160.6
[M+Na-2H]-	255.14789	163.1
[M]+	234.17267	159.7
[M]-	234.17377	159.7

Literature stripe

literature stripe

Patent stripe

patents stripe