CID 2794134

618092-22-1

Structural Information

Molecular Formula

C₂₂H₂₀N₂

SMILES

C1=CC=C2C(=C1)C=CC=C2C(C(C3=CC=CC4=CC=CC=C43)N)N

InChI

InChI=1S/C22H20N2/c23-21(19-13-5-9-15-7-1-3-11-17(15)19)22(24)20-14-6-10-16-8-2-4-12-18(16)20/h1-14,21-22H,23-24H2

InChIKey

VVJVMUUCGDSHBT-UHFFFAOYSA-N

Compound name

1,2-dinaphthalen-1-ylethane-1,2-diamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 92
Patents: 312.16266 Da
Monoisotopic Mass: 3.9
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]+	313.169936	173.2
[M+Na]+	335.151878	179.5
[M-H]-	311.155384	180.3
[M+NH4]+	330.196483	188.1
[M+K]+	351.125818	172.7
[M+H-H2O]+	295.159920	164.3
[M+HCOO]-	357.160861	194.3
[M+CH3COO]-	371.176511	183.4
[M+Na-2H]-	333.137326	179.4
[M]+	312.16211142	170.1
[M]-	312.16320858	170.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe