CID 491474

2-propen-1-amine, 3-(4'-bromo[1,1'-biphenyl]-4-yl)-3-(4-bromophenyl)-n,n-dimethyl-, (2e)-

Structural Information

Molecular Formula
C23H21Br2N
SMILES
CN(C)CC=C(C1=CC=C(C=C1)C2=CC=C(C=C2)Br)C3=CC=C(C=C3)Br
InChI
InChI=1S/C23H21Br2N/c1-26(2)16-15-23(20-9-13-22(25)14-10-20)19-5-3-17(4-6-19)18-7-11-21(24)12-8-18/h3-15H,16H2,1-2H3
InChIKey
APCRSTXXOLXSBM-UHFFFAOYSA-N
Compound name
3-(4-bromophenyl)-3-[4-(4-bromophenyl)phenyl]-N,N-dimethylprop-2-en-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

469.00406 Da
Monoisotopic Mass

7.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 470.01134 190.3
[M+Na]+ 491.99328 197.4
[M-H]- 467.99678 201.5
[M+NH4]+ 487.03788 203.5
[M+K]+ 507.96722 181.5
[M+H-H2O]+ 452.00132 195.8
[M+HCOO]- 514.00226 205.2
[M+CH3COO]- 528.01791 233.2
[M+Na-2H]- 489.97873 192.4
[M]+ 469.00351 223.6
[M]- 469.00461 223.6
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

No patent data available for this compound.