CID 3062504

1-(2-(4-phenyl-1-piperazinyl)ethyl)indane hydrochloride

Structural Information

Molecular Formula
C21H26N2
SMILES
C1CC2=CC=CC=C2C1CCN3CCN(CC3)C4=CC=CC=C4
InChI
InChI=1S/C21H26N2/c1-2-7-20(8-3-1)23-16-14-22(15-17-23)13-12-19-11-10-18-6-4-5-9-21(18)19/h1-9,19H,10-17H2
InChIKey
FZJZYFYINDWXSJ-UHFFFAOYSA-N
Compound name
1-[2-(2,3-dihydro-1H-inden-1-yl)ethyl]-4-phenylpiperazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

306.2096 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 307.21688 178.0
[M+Na]+ 329.19882 192.1
[M+NH4]+ 324.24342 187.8
[M+K]+ 345.17276 183.7
[M-H]- 305.20232 184.6
[M+Na-2H]- 327.18427 186.4
[M]+ 306.20905 182.0
[M]- 306.21015 182.0
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.