CID 212115

Piperidine, 1-(2-(2-phenylinden-3-yl)ethyl)-, hydrochloride

Structural Information

Molecular Formula
C22H25N
SMILES
C1CCN(CC1)CCC2=C(CC3=CC=CC=C32)C4=CC=CC=C4
InChI
InChI=1S/C22H25N/c1-3-9-18(10-4-1)22-17-19-11-5-6-12-20(19)21(22)13-16-23-14-7-2-8-15-23/h1,3-6,9-12H,2,7-8,13-17H2
InChIKey
IUARIIJQNRKLOX-UHFFFAOYSA-N
Compound name
1-[2-(2-phenyl-3H-inden-1-yl)ethyl]piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

303.1987 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 304.20598 175.0
[M+Na]+ 326.18792 179.5
[M-H]- 302.19142 182.8
[M+NH4]+ 321.23252 190.6
[M+K]+ 342.16186 172.7
[M+H-H2O]+ 286.19596 165.0
[M+HCOO]- 348.19690 192.8
[M+CH3COO]- 362.21255 184.7
[M+Na-2H]- 324.17337 176.4
[M]+ 303.19815 170.4
[M]- 303.19925 170.4
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.