CID 39593

Ethylmethylglycinexylidide

Structural Information

Molecular Formula

C₁₃H₂₀N₂O

SMILES

CCN(C)CC(=O)NC1=C(C=CC=C1C)C

InChI

InChI=1S/C13H20N2O/c1-5-15(4)9-12(16)14-13-10(2)7-6-8-11(13)3/h6-8H,5,9H2,1-4H3,(H,14,16)

InChIKey

OTLWVFWFTXURLI-UHFFFAOYSA-N

Compound name

N-(2,6-dimethylphenyl)-2-[ethyl(methyl)amino]acetamide

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 1
References: 20
Patents: 220.15756 Da
Monoisotopic Mass: 1.9
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]+	221.16484	152.7
[M+Na]+	243.14678	158.7
[M-H]-	219.15028	157.7
[M+NH4]+	238.19138	171.6
[M+K]+	259.12072	157.6
[M+H-H2O]+	203.15482	145.8
[M+HCOO]-	265.15576	177.9
[M+CH3COO]-	279.17141	200.3
[M+Na-2H]-	241.13223	155.8
[M]+	220.15701	154.6
[M]-	220.15811	154.6

Literature stripe

literature stripe

Patent stripe

patents stripe