CID 3055381

72336-03-9

Structural Information

Molecular Formula

C₁₁H₁₆N₂O

SMILES

CN(C)CC(=O)NCC1=CC=CC=C1

InChI

InChI=1S/C11H16N2O/c1-13(2)9-11(14)12-8-10-6-4-3-5-7-10/h3-7H,8-9H2,1-2H3,(H,12,14)

InChIKey

OXCIYKRGQKBKTL-UHFFFAOYSA-N

Compound name

N-benzyl-2-(dimethylamino)acetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 9
Patents: 192.12627 Da
Monoisotopic Mass: 1.1
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]+	193.13355	144.1
[M+Na]+	215.11549	149.2
[M-H]-	191.11899	148.8
[M+NH4]+	210.16009	163.5
[M+K]+	231.08943	148.5
[M+H-H2O]+	175.12353	137.1
[M+HCOO]-	237.12447	170.0
[M+CH3COO]-	251.14012	191.9
[M+Na-2H]-	213.10094	149.8
[M]+	192.12572	144.5
[M]-	192.12682	144.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe