CID 3043628

55875-63-3

Structural Information

Molecular Formula
C23H26N2
SMILES
CC(CC1=CC=C(C=C1)N(CC2=CC=CC=C2)CC3=CC=CC=C3)N
InChI
InChI=1S/C23H26N2/c1-19(24)16-20-12-14-23(15-13-20)25(17-21-8-4-2-5-9-21)18-22-10-6-3-7-11-22/h2-15,19H,16-18,24H2,1H3
InChIKey
FRNJTELNFBQZIN-UHFFFAOYSA-N
Compound name
4-(2-aminopropyl)-N,N-dibenzylaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

330.2096 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 331.216876 182.9
[M+Na]+ 353.198818 185.8
[M-H]- 329.202324 192.1
[M+NH4]+ 348.243423 195.4
[M+K]+ 369.172758 180.5
[M+H-H2O]+ 313.206860 172.4
[M+HCOO]- 375.207801 206.2
[M+CH3COO]- 389.223451 219.3
[M+Na-2H]- 351.184266 185.7
[M]+ 330.20905142 180.9
[M]- 330.21014858 180.9
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.