CID 203398

14307-89-2

Structural Information

Molecular Formula

C₁₀H₁₄N₂O

SMILES

CN(C)C(=O)CNC1=CC=CC=C1

InChI

InChI=1S/C10H14N2O/c1-12(2)10(13)8-11-9-6-4-3-5-7-9/h3-7,11H,8H2,1-2H3

InChIKey

MLCBUWNEWJFXJX-UHFFFAOYSA-N

Compound name

2-anilino-N,N-dimethylacetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 56
Patents: 178.11061 Da
Monoisotopic Mass: 0.6
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]+	179.117886	139.5
[M+Na]+	201.099828	144.9
[M-H]-	177.103334	144.3
[M+NH4]+	196.144433	159.4
[M+K]+	217.073768	144.5
[M+H-H2O]+	161.107870	132.6
[M+HCOO]-	223.108811	165.7
[M+CH3COO]-	237.124461	188.9
[M+Na-2H]-	199.085276	145.7
[M]+	178.11006142	139.5
[M]-	178.11115858	139.5

Literature stripe

literature stripe

Patent stripe

patents stripe