CID 211180

22593-83-5

Structural Information

Molecular Formula
C26H32N2
SMILES
CC(CC1=CC=C(C=C1)CC(C)NCC2=CC=CC=C2)NCC3=CC=CC=C3
InChI
InChI=1S/C26H32N2/c1-21(27-19-25-9-5-3-6-10-25)17-23-13-15-24(16-14-23)18-22(2)28-20-26-11-7-4-8-12-26/h3-16,21-22,27-28H,17-20H2,1-2H3
InChIKey
TYXBKGIEZYBZMX-UHFFFAOYSA-N
Compound name
N-benzyl-1-[4-[2-(benzylamino)propyl]phenyl]propan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

372.25656 Da
Monoisotopic Mass

5.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 373.263836 195.1
[M+Na]+ 395.245778 196.2
[M-H]- 371.249284 202.8
[M+NH4]+ 390.290383 205.4
[M+K]+ 411.219718 189.8
[M+H-H2O]+ 355.253820 184.3
[M+HCOO]- 417.254761 216.5
[M+CH3COO]- 431.270411 226.2
[M+Na-2H]- 393.231226 197.0
[M]+ 372.25601142 193.2
[M]- 372.25710858 193.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.