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]+ 318.22164 179.5
[M+Na]+ 340.20358 183.5
[M-H]- 316.20708 187.1
[M+NH4]+ 335.24818 194.5
[M+K]+ 356.17752 176.5
[M+H-H2O]+ 300.21162 169.3
[M+HCOO]- 362.21256 197.0
[M+CH3COO]- 376.22821 188.8
[M+Na-2H]- 338.18903 180.3
[M]+ 317.21381 175.2
[M]- 317.21491 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.