CID 3046628

1-(3,3-diphenylpropyl)-4-phenylpiperazine dihydrochloride

Structural Information

Molecular Formula
C25H28N2
SMILES
C1CN(CCN1CCC(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4
InChI
InChI=1S/C25H28N2/c1-4-10-22(11-5-1)25(23-12-6-2-7-13-23)16-17-26-18-20-27(21-19-26)24-14-8-3-9-15-24/h1-15,25H,16-21H2
InChIKey
XOJYHFCSSPXFPS-UHFFFAOYSA-N
Compound name
1-(3,3-diphenylpropyl)-4-phenylpiperazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

356.22525 Da
Monoisotopic Mass

5.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 357.23253 189.7
[M+Na]+ 379.21447 191.3
[M-H]- 355.21797 196.9
[M+NH4]+ 374.25907 197.6
[M+K]+ 395.18841 183.9
[M+H-H2O]+ 339.22251 176.4
[M+HCOO]- 401.22345 204.4
[M+CH3COO]- 415.23910 196.6
[M+Na-2H]- 377.19992 191.6
[M]+ 356.22470 183.0
[M]- 356.22580 183.0
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.