CID 278305

1-piperazineethanol, alpha-benzyl-4-phenyl-

Structural Information

Molecular Formula
C19H24N2O
SMILES
C1CN(CCN1CC(CC2=CC=CC=C2)O)C3=CC=CC=C3
InChI
InChI=1S/C19H24N2O/c22-19(15-17-7-3-1-4-8-17)16-20-11-13-21(14-12-20)18-9-5-2-6-10-18/h1-10,19,22H,11-16H2
InChIKey
WTIYVDBHKOAGAR-UHFFFAOYSA-N
Compound name
1-phenyl-3-(4-phenylpiperazin-1-yl)propan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

296.18887 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 297.196146 172.6
[M+Na]+ 319.178088 175.3
[M-H]- 295.181594 176.4
[M+NH4]+ 314.222693 183.2
[M+K]+ 335.152028 169.7
[M+H-H2O]+ 279.186130 161.8
[M+HCOO]- 341.187071 187.2
[M+CH3COO]- 355.202721 180.7
[M+Na-2H]- 317.163536 175.1
[M]+ 296.18832142 166.6
[M]- 296.18941858 166.6
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.