CID 3292101

1,3-bis[2-(4-aminophenyl)-2-propyl]benzene

Structural Information

Molecular Formula
C24H28N2
SMILES
CC(C)(C1=CC=C(C=C1)N)C2=CC(=CC=C2)C(C)(C)C3=CC=C(C=C3)N
InChI
InChI=1S/C24H28N2/c1-23(2,17-8-12-21(25)13-9-17)19-6-5-7-20(16-19)24(3,4)18-10-14-22(26)15-11-18/h5-16H,25-26H2,1-4H3
InChIKey
KWOIWTRRPFHBSI-UHFFFAOYSA-N
Compound name
4-[2-[3-[2-(4-aminophenyl)propan-2-yl]phenyl]propan-2-yl]aniline
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

6022
Patents

344.22525 Da
Monoisotopic Mass

6.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 345.23253 186.9
[M+Na]+ 367.21447 192.4
[M-H]- 343.21797 195.5
[M+NH4]+ 362.25907 199.0
[M+K]+ 383.18841 186.1
[M+H-H2O]+ 327.22251 178.1
[M+HCOO]- 389.22345 206.6
[M+CH3COO]- 403.23910 220.9
[M+Na-2H]- 365.19992 190.4
[M]+ 344.22470 183.7
[M]- 344.22580 183.7
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