CID 294528

2-(diethylamino)malondianilide

Structural Information

Molecular Formula

C₁₉H₂₃N₃O₂

SMILES

CCN(CC)C(C(=O)NC1=CC=CC=C1)C(=O)NC2=CC=CC=C2

InChI

InChI=1S/C19H23N3O2/c1-3-22(4-2)17(18(23)20-15-11-7-5-8-12-15)19(24)21-16-13-9-6-10-14-16/h5-14,17H,3-4H2,1-2H3,(H,20,23)(H,21,24)

InChIKey

ZXAZSOMSADQJHY-UHFFFAOYSA-N

Compound name

2-(diethylamino)-N,N'-diphenylpropanediamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 325.17902 Da
Monoisotopic Mass: 4.1
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]+	326.186296	179.8
[M+Na]+	348.168238	181.3
[M-H]-	324.171744	186.6
[M+NH4]+	343.212843	192.5
[M+K]+	364.142178	179.3
[M+H-H2O]+	308.176280	170.1
[M+HCOO]-	370.177221	203.8
[M+CH3COO]-	384.192871	219.1
[M+Na-2H]-	346.153686	182.0
[M]+	325.17847142	179.1
[M]-	325.17956858	179.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe