CID 16792360

1255717-19-1

Structural Information

Molecular Formula

C₁₀H₁₅N₃O

SMILES

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

InChI

InChI=1S/C10H15N3O/c1-13(2)7-10(14)12-9-5-3-4-8(11)6-9/h3-6H,7,11H2,1-2H3,(H,12,14)

InChIKey

KYMQEQGMSAPIEH-UHFFFAOYSA-N

Compound name

N-(3-aminophenyl)-2-(dimethylamino)acetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 36
Patents: 193.1215 Da
Monoisotopic Mass: 0.0
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]+	194.12878	143.6
[M+Na]+	216.11072	149.1
[M-H]-	192.11422	148.2
[M+NH4]+	211.15532	162.5
[M+K]+	232.08466	148.4
[M+H-H2O]+	176.11876	136.5
[M+HCOO]-	238.11970	170.1
[M+CH3COO]-	252.13535	194.5
[M+Na-2H]-	214.09617	148.2
[M]+	193.12095	142.2
[M]-	193.12205	142.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe