CID 91079

1-(3-(p-chlorophenyl)-3-phenylpropyl)-4-(2-hydroxypropyl)piperazine dimaleate

Structural Information

Molecular Formula
C22H29ClN2O
SMILES
CC(CN1CCN(CC1)CCC(C2=CC=CC=C2)C3=CC=C(C=C3)Cl)O
InChI
InChI=1S/C22H29ClN2O/c1-18(26)17-25-15-13-24(14-16-25)12-11-22(19-5-3-2-4-6-19)20-7-9-21(23)10-8-20/h2-10,18,22,26H,11-17H2,1H3
InChIKey
LFKOKGROIUWPMC-UHFFFAOYSA-N
Compound name
1-[4-[3-(4-chlorophenyl)-3-phenylpropyl]piperazin-1-yl]propan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

372.19684 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 373.20412 193.1
[M+Na]+ 395.18606 207.0
[M+NH4]+ 390.23066 200.8
[M+K]+ 411.16000 197.9
[M-H]- 371.18956 198.2
[M+Na-2H]- 393.17151 201.1
[M]+ 372.19629 196.9
[M]- 372.19739 196.9
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.