CID 5017451

51050-64-7

Structural Information

Molecular Formula
C27H26N2
SMILES
C1=CC=C(C=C1)CNC2=CC=C(C=C2)CC3=CC=C(C=C3)NCC4=CC=CC=C4
InChI
InChI=1S/C27H26N2/c1-3-7-24(8-4-1)20-28-26-15-11-22(12-16-26)19-23-13-17-27(18-14-23)29-21-25-9-5-2-6-10-25/h1-18,28-29H,19-21H2
InChIKey
LAAHVRSMWAXJMP-UHFFFAOYSA-N
Compound name
N-benzyl-4-[[4-(benzylamino)phenyl]methyl]aniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

378.2096 Da
Monoisotopic Mass

6.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 379.21688 199.7
[M+Na]+ 401.19882 217.0
[M+NH4]+ 396.24342 209.3
[M+K]+ 417.17276 204.1
[M-H]- 377.20232 211.4
[M+Na-2H]- 399.18427 214.5
[M]+ 378.20905 205.9
[M]- 378.21015 205.9
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