CID 201809

Benzidine, n,n,n',n'-tetraethyl-

Structural Information

Molecular Formula
C20H28N2
SMILES
CCN(CC)C1=CC=C(C=C1)C2=CC=C(C=C2)N(CC)CC
InChI
InChI=1S/C20H28N2/c1-5-21(6-2)19-13-9-17(10-14-19)18-11-15-20(16-12-18)22(7-3)8-4/h9-16H,5-8H2,1-4H3
InChIKey
BDZHBJPMMZFUJV-UHFFFAOYSA-N
Compound name
4-[4-(diethylamino)phenyl]-N,N-diethylaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

121
Patents

296.22525 Da
Monoisotopic Mass

5.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 297.23253 175.7
[M+Na]+ 319.21447 180.0
[M-H]- 295.21797 184.3
[M+NH4]+ 314.25907 191.7
[M+K]+ 335.18841 177.4
[M+H-H2O]+ 279.22251 166.3
[M+HCOO]- 341.22345 201.0
[M+CH3COO]- 355.23910 218.9
[M+Na-2H]- 317.19992 178.1
[M]+ 296.22470 178.7
[M]- 296.22580 178.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe