CID 77836

N,n'-dicyclohexyl-p-phenylenediamine

Structural Information

Molecular Formula

C₁₈H₂₈N₂

SMILES

C1CCC(CC1)NC2=CC=C(C=C2)NC3CCCCC3

InChI

InChI=1S/C18H28N2/c1-3-7-15(8-4-1)19-17-11-13-18(14-12-17)20-16-9-5-2-6-10-16/h11-16,19-20H,1-10H2

InChIKey

AIMXDOGPMWDCDF-UHFFFAOYSA-N

Compound name

1-N,4-N-dicyclohexylbenzene-1,4-diamine

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 1
References: 5841
Patents: 272.22525 Da
Monoisotopic Mass: 5.5
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]+	273.23253	170.2
[M+Na]+	295.21447	180.6
[M+NH4]+	290.25907	180.0
[M+K]+	311.18841	171.5
[M-H]-	271.21797	178.4
[M+Na-2H]-	293.19992	178.7
[M]+	272.22470	173.8
[M]-	272.22580	173.8

Literature stripe

literature stripe

Patent stripe

patents stripe