CID 6432140

4408-47-3

Structural Information

Molecular Formula

C₁₆H₁₈N₄

SMILES

C1=CC=C(C(=C1)C=NCCN=CC2=CC=CC=C2N)N

InChI

InChI=1S/C16H18N4/c17-15-7-3-1-5-13(15)11-19-9-10-20-12-14-6-2-4-8-16(14)18/h1-8,11-12H,9-10,17-18H2

InChIKey

ZFIFWHZGMOGXDV-UHFFFAOYSA-N

Compound name

2-[2-[(2-aminophenyl)methylideneamino]ethyliminomethyl]aniline

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 103
Patents: 266.15314 Da
Monoisotopic Mass: 1.4
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]+	267.16042	164.6
[M+Na]+	289.14236	176.3
[M+NH4]+	284.18696	172.6
[M+K]+	305.11630	167.7
[M-H]-	265.14586	171.8
[M+Na-2H]-	287.12781	173.9
[M]+	266.15259	168.1
[M]-	266.15369	168.1

Literature stripe

literature stripe

Patent stripe

patents stripe