CID 58292

4-(dimethylamino)methyleneaminoquinaldine

Structural Information

Molecular Formula

C₁₃H₁₅N₃

SMILES

CC1=NC2=CC=CC=C2C(=C1)N=CN(C)C

InChI

InChI=1S/C13H15N3/c1-10-8-13(14-9-16(2)3)11-6-4-5-7-12(11)15-10/h4-9H,1-3H3

InChIKey

JSSMTNFNQJIGJE-UHFFFAOYSA-N

Compound name

N,N-dimethyl-N'-(2-methylquinolin-4-yl)methanimidamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 2
References: 0
Patents: 213.1266 Da
Monoisotopic Mass: 2.5
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]+	214.133876	147.3
[M+Na]+	236.115818	155.6
[M-H]-	212.119324	153.4
[M+NH4]+	231.160423	166.9
[M+K]+	252.089758	153.3
[M+H-H2O]+	196.123860	139.2
[M+HCOO]-	258.124801	173.4
[M+CH3COO]-	272.140451	200.0
[M+Na-2H]-	234.101266	155.8
[M]+	213.12605142	149.6
[M]-	213.12714858	149.6

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.