CID 203564

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

Structural Information

Molecular Formula
C23H27N
SMILES
C1CCN(CC1)CCC2=C(CC3=CC=CC=C32)CC4=CC=CC=C4
InChI
InChI=1S/C23H27N/c1-3-9-19(10-4-1)17-21-18-20-11-5-6-12-22(20)23(21)13-16-24-14-7-2-8-15-24/h1,3-6,9-12H,2,7-8,13-18H2
InChIKey
SDUGTYSHISEFCZ-UHFFFAOYSA-N
Compound name
1-[2-(2-benzyl-3H-inden-1-yl)ethyl]piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

317.21436 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 318.221636 179.5
[M+Na]+ 340.203578 183.5
[M-H]- 316.207084 187.1
[M+NH4]+ 335.248183 194.5
[M+K]+ 356.177518 176.5
[M+H-H2O]+ 300.211620 169.3
[M+HCOO]- 362.212561 197.0
[M+CH3COO]- 376.228211 188.8
[M+Na-2H]- 338.189026 180.3
[M]+ 317.21381142 175.2
[M]- 317.21490858 175.2
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.