CID 6476751

(z)-3-[4-(4-bromophenyl)phenyl]-3-(4-chlorophenyl)-n,n-dimethyl-prop-2-en-1-amine

Structural Information

Molecular Formula
C23H21BrClN
SMILES
CN(C)C/C=C(/C1=CC=C(C=C1)C2=CC=C(C=C2)Br)\C3=CC=C(C=C3)Cl
InChI
InChI=1S/C23H21BrClN/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/b23-15-
InChIKey
OISHCEIEGCYJDH-HAHDFKILSA-N
Compound name
(Z)-3-[4-(4-bromophenyl)phenyl]-3-(4-chlorophenyl)-N,N-dimethylprop-2-en-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

425.0546 Da
Monoisotopic Mass

7.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 426.06188 195.8
[M+Na]+ 448.04382 205.3
[M-H]- 424.04732 208.0
[M+NH4]+ 443.08842 210.6
[M+K]+ 464.01776 190.6
[M+H-H2O]+ 408.05186 193.1
[M+HCOO]- 470.05280 211.9
[M+CH3COO]- 484.06845 207.5
[M+Na-2H]- 446.02927 197.8
[M]+ 425.05405 216.3
[M]- 425.05515 216.3
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.