CID 3021822

91429-96-8

Structural Information

Molecular Formula

C₁₁H₁₆N₂O

SMILES

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

InChI

InChI=1S/C11H16N2O/c1-9(11(14)13(2)3)12-10-7-5-4-6-8-10/h4-9,12H,1-3H3

InChIKey

VFZPIFLLROZMDL-UHFFFAOYSA-N

Compound name

2-anilino-N,N-dimethylpropanamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 2
Patents: 192.12627 Da
Monoisotopic Mass: 1.8
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]+	193.133546	144.6
[M+Na]+	215.115488	149.4
[M-H]-	191.118994	149.3
[M+NH4]+	210.160093	163.9
[M+K]+	231.089428	149.2
[M+H-H2O]+	175.123530	137.7
[M+HCOO]-	237.124471	169.5
[M+CH3COO]-	251.140121	192.8
[M+Na-2H]-	213.100936	149.0
[M]+	192.12572142	144.3
[M]-	192.12681858	144.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe